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5 Pull requests merged by 4 people
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Updating compiler support and test cases
#634 merged
Oct 16, 2024 -
Fix multihead prediction for eval_configs.py
#642 merged
Oct 16, 2024 -
Update training.rst
#638 merged
Oct 16, 2024 -
Update README.md using bibtex
#628 merged
Oct 10, 2024 -
Fix compile_mode in MACECalculator
#632 merged
Oct 10, 2024
1 Pull request opened by 1 person
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Added some parameter in eval_mu_alpha.py
#636 opened
Oct 12, 2024
2 Issues closed by 2 people
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Unit of get_potential_energy()
#630 closed
Oct 15, 2024 -
ASE Calculator example fails when using compile_mode
#631 closed
Oct 10, 2024
5 Issues opened by 5 people
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Is it possible to develop ReaxFF force fields in LAMMPS-MACE?
#641 opened
Oct 16, 2024 -
NaCl cube example missing in drive (example-xyz-movie/aqueous interface/NaCl_cube)
#640 opened
Oct 15, 2024 -
MACE compile mode test failures with InternalTorchDynamoError and Unsupported exceptions in main
#639 opened
Oct 15, 2024 -
better default for device used to _save_ model in run_train
#635 opened
Oct 11, 2024 -
Model architecture with --model="ScaleShiftMACE"
#633 opened
Oct 10, 2024