MobleyLab/benchmarkff

Compare optimized geometries and energies from various force fields with respect to a QM reference.

PythonStars 13Forks 8Watchers 13Open issues 9License MIT License

Details

仓库信息

OwnerMobleyLab

Homepage—

Last pushed2021-04-19

Last updated2025-12-15

Issues fetched at—

Community at a glance