这里会显示出您选择的修订版和当前版本之间的差别。
两侧同时换到之前的修订记录前一修订版后一修订版 | 前一修订版上一修订版两侧同时换到之后的修订记录 | ||
adf:reaxffmodule [2019/12/10 13:25] – liu.jun | adf:reaxffmodule [2020/11/25 12:33] – liu.jun | ||
---|---|---|---|
行 6: | 行 6: | ||
<WRAP half column> | <WRAP half column> | ||
* [[adf: | * [[adf: | ||
- | * [[adf:filesofReaxFF]] | + | * [[adf:OptimizeFF]] |
- | * [[https:// | + | * [[adf:OptimizeFF_crystal]] |
- | * [[https:// | + | |
- | * [[adf:meaningofparameters]] | + | |
</ | </ | ||
<WRAP half column> | <WRAP half column> | ||
- | * [[adf: | ||
- | * [[adf: | ||
* [[https:// | * [[https:// | ||
- | * [[https://www.scm.com/doc.trunk/Tutorials/ | + | * [[https://downloads.scm.com/distr/ReaxFF-force-field-fitting-CMA-ES.mp4|CMA-ES方法优化力场视频教程(英文)]] |
- | + | ||
</ | </ | ||
</ | </ | ||
行 40: | 行 33: | ||
<WRAP half column> | <WRAP half column> | ||
=====功能教程===== | =====功能教程===== | ||
- | |||
- | * [[adf: | ||
* [[adf: | * [[adf: | ||
* [[adf: | * [[adf: | ||
行 49: | 行 40: | ||
* [[adf:RED]] | * [[adf:RED]] | ||
* [[adf: | * [[adf: | ||
- | * [[adf: | ||
* [[adf: | * [[adf: | ||
* [[adf: | * [[adf: | ||
行 59: | 行 49: | ||
* [[adf: | * [[adf: | ||
* [[adf: | * [[adf: | ||
+ | * [[https:// | ||
+ | * [[https:// | ||
+ | * [[https:// | ||
</ | </ | ||
行 74: | 行 67: | ||
* [[adf: | * [[adf: | ||
* [[adf: | * [[adf: | ||
- | * [[adf: | ||
- | |||
</ | </ | ||
</ | </ |