Commit Graph

7 Commits

Author SHA1 Message Date
31c3ab0734 总能量应该是potential 2025-01-06 20:40:51 +08:00
4d0c41d222 优化三个工具的返回结果。 2025-01-06 17:27:45 +08:00
c7d2d482da 重构代码 2025-01-06 14:54:41 +08:00
c2417fec25 修改mp的实现 2025-01-06 10:03:38 +08:00
5380ee5f9e fairchem 2025-01-05 17:43:06 +08:00
f214f51e12 oqmd 2025-01-04 20:08:03 +08:00
1f8557a918 Initial commit 2024-12-26 11:24:30 +08:00