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Python

mattersim

MatterSim: A deep learning atomistic model across elements, temperatures and pressures.

PythonEmerging

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8

Last push

17mo ago

Recent commits

Latest commits.

Update finetune.rst (#80)
d19370dHan Yang17mo ago
docs: add finetune docs (#78)
ee63939Xixian Liu17mo ago
Fix: finetune error with cpu device (#76)
bebbbd0Xixian Liu17mo ago
Update phonon.py (#77)
ba7c4e6Han Yang17mo ago
Add tests and README for batch relaxation (#75)
0621694Claudio Zeni18mo ago

Add batch relaxation script (#73)

a81944cClaudio Zeni18mo ago

ci: update workflows (#72)

81e6b01Han Yang18mo ago

refactor: move finetune_mattersim.py to src/training folder (#71)

4c99230Xixian Liu18mo ago

Top contributors

Builders behind this project.

yanghan-microsoft