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CederGroupHub / chgnet

Pretrained universal neural network potential for charge-informed atomistic modeling https://chgnet.lbl.gov
https://doi.org/10.1038/s42256-023-00716-3
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`cuda_devices_sorted_by_free_mem()` return [] if `not torch.cuda.is_available()` #115

Closed janosh closed 5 months ago

janosh commented 5 months ago

9392d2c cuda_devices_sorted_by_free_mem() return [] if not torch.cuda.is_available() 3768cdc refactor test_md_crystal_feas_log e304450 change parse_vasp_dir() empty data exception type to RuntimeError 856349b remove unused mkdir util e2579aa type annos