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48 changes: 48 additions & 0 deletions CITATION.cff
Original file line number Diff line number Diff line change
@@ -0,0 +1,48 @@
cff-version: 1.2.0
message: "If you use GBasis in your research, please cite the following paper."
title: "GBasis"
type: software
url: "https://github.com/theochem/gbasis"
license: "BSD-3-Clause"

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GBasis is licensed under the GNU LESSER GENERAL PUBLIC LICENSE

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This is just a small change. I will add it myself

preferred-citation:
type: article
title: "GBasis: A Python Library for Evaluating Functions, Functionals, and Integrals Expressed with Gaussian Basis Functions."
authors:
- family-names: Kim
given-names: Taejin D.
- family-names: Pujal
given-names: Leila
- family-names: Richer
given-names: Michelle
- family-names: van Zyl
given-names: Max
- family-names: Martínez-González
given-names: Marco
- family-names: Tehrani
given-names: Amir
- family-names: Chuiko
given-names: Vladislav
- family-names: Sánchez-Díaz
given-names: Gabriel
- family-names: Sanchez
given-names: William
- family-names: Adams
given-names: William
- family-names: Huang
given-names: X.
- family-names: Kelly
given-names: Brian D.
- family-names: Vöhringer-Martinez
given-names: Esteban
- family-names: Verstraelen
given-names: Toon
- family-names: Heidar-Zadeh
given-names: Farnaz
- family-names: Ayers
given-names: Paul W.
journal: "The Journal of Chemical Physics"
volume: 161
issue: 4
pages: 042503
year: 2024
doi: "10.1063/5.0216776"