adf:scriptofadf
差别
| 两侧同时换到之前的修订记录前一修订版后一修订版 | 前一修订版 |
| adf:scriptofadf [2019/03/11 19:42] – liu.jun | adf:scriptofadf [2020/11/27 19:07] (当前版本) – liu.jun |
|---|
| ======PLAMS：Python库与接口====== | ======PLAMS：Python库与接口====== |
| * [[https://www.scm.com/wp-content/uploads/Videos/PLAMS_Scripting_SetUp_ADFCommandLine_MacOS.mp4|视频教程（英文）]] | * [[https://www.scm.com/doc/plams|英文手册]] |
| * [[https://www.scm.com/product/plams/|详细介绍]] | * [[https://www.scm.com/doc/Tutorials/WorkflowsAndAutomation/PythonScriptingWithPLAMS.html|Python Scripting With PLAMS]] |
| | * [[https://www.scm.com/doc/Tutorials/WorkflowsAndAutomation/GeneratingABatchOfJobs.html|Generating a batch of jobs and collecting results: Basis Set Effects for NH3 Geometry]] |
| | * [[https://www.scm.com/doc/Tutorials/WorkflowsAndAutomation/MultipleMoleculesConformersMethods.html|Multiple molecules, conformers, multiple methods]] |
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adf/scriptofadf.1552304527.txt.gz · 最后更改: 2019/03/11 19:42 由 liu.jun
