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[Feat]: MD Accelaration and LAMMPS Integration
#66
opened Dec 20, 2024 by
HNUSTLingjunWu
1 of 4 tasks
[Feat]: Add finetune method to mattersim
enhancement
New feature or request
#63
opened Dec 11, 2024 by
Liusiyuan2022
2 of 4 tasks
[Bug]: moldyn.py line 103 calls NPT when you select NVT_NOSE_HOOVER
bug
Something isn't working
#60
opened Dec 6, 2024 by
dundarphys
1 task done
[Feat]: Verbose Option to relaxer
enhancement
New feature or request
#59
opened Dec 6, 2024 by
dundar11
2 of 4 tasks
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