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简介:

VaspCZ(Vasp Check by Zzd)是作者在读博期间为提高科研效率而开发的Vasp辅助程序,该程序包含三个模块:结构优化和静态计算(OS)模块、过渡态计算(NEB)模块和测试(Test)模块,并提供了Linux用户界面。

【程序框架图】

【各个模块功能介绍】

当前版本: 1.0.1

安装和使用

git clone https://github.com/zhangzhengde0225/VaspCZ.git

Metadata

Release files for VaspCZ 1.0.2

For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.

Source distribution (sdist)

Source distribution for VaspCZ 1.0.2
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VaspCZ-1.0.2.tar.gz 1.6 kB Details

Release files / VaspCZ-1.0.2.tar.gz

Download URL VaspCZ-1.0.2.tar.gz
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1.0.2 This release

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