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cmake-build-debug
cmake-build-debug
 
 
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.DS_Store
 
 
CMakeLists.txt
CMakeLists.txt
 
 
README.md
README.md
 
 
config_io.cpp
config_io.cpp
 
 
config_io.h
config_io.h
 
 
input_box.txt
input_box.txt
 
 
input_box1.txt
input_box1.txt
 
 
input_box2.txt
input_box2.txt
 
 
input_test.cpp
input_test.cpp
 
 
luban_mc_npt.cpp
luban_mc_npt.cpp
 
 
luban_mc_npt.h
luban_mc_npt.h
 
 
luban_mc_nvt.cpp
luban_mc_nvt.cpp
 
 
luban_mc_nvt.h
luban_mc_nvt.h
 
 
luban_reduced_units_zvt.cpp
luban_reduced_units_zvt.cpp
 
 
luban_test.cpp
luban_test.cpp
 
 
luban_vector_refactoring.cpp
luban_vector_refactoring.cpp
 
 
main.cpp
main.cpp
 
 
metropolis.cpp
metropolis.cpp
 
 
metropolis.py
metropolis.py
 
 
monte_carlo.cpp
monte_carlo.cpp
 
 
potential_debug.cpp
potential_debug.cpp
 
 
random_tranlate_test.cpp
random_tranlate_test.cpp
 
 

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MCCPS-Luban(Monte Carlo Complex Planetary Systems）

蒙特卡洛复杂行星系统——鲁班

内容

概览

Luban是由成都理工大学行星科学国际研究中心张力文等人开发的开源 Gibbs Ensemble Monte Carlo 包，用于模拟行星高温高压下条件下的相平衡与相分离。 Luban适用于计算流体的热力学性质和相平衡，处理势能为Lennard-Jones势。

特点

  1. 系综
  • 正则系综
  • 等温-等压系综
  • 巨正则系综
  1. 移动
  • 平移移动
  • 体积移动
  • 转移移动
  1. 势能
  • LJ势能
  1. 其他

截断方法：cut、cut and shift、standard long-tail correction

安装

> git clone
https://github.com/gszhlw/MCCPS-Luban

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