Add ase_interface with support for optimization and md

Open JunnHuo opened this issue 5 months ago • 4 comments

Jul 10 '25 06:07 JunnHuo

All committers have signed the CLA.

Jul 10 '25 06:07 CLAassistant

predictor和calculator建议取消掉ppmat，和trainer保持类似的命名一致性规则

Jul 11 '25 03:07 leeleolay

predictor和calculator逻辑拆分的还是有点问题

Jul 18 '25 07:07 leeleolay

辛苦提供一个readme文档，怎么运行；requirement里添加hydra

Sep 28 '25 12:09 leeleolay

我的测试版本是paddle3.2.2,cuda12.0

Dec 08 '25 12:12 leeleolay