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mlip-arena / mlip_arena /models /externals.py

Commit History

Add calculator test (#6)

1c7cd6c
unverified

Yuan (Cyrus) Chiang commited on Sep 20, 2024

update external calculator classes; update diatomic curves

cf512f3

cyrusyc commited on Sep 19, 2024

add orb model to diatomic tasks

05e8129

cyrusyc commited on Sep 11, 2024

update combustion

7c36d54

cyrusyc commited on Aug 23, 2024

add EquiformerV2 OC20 ckpt

03db5cf

cyrusyc commited on Jul 28, 2024

add m3gnet diatomic task

8a5a7ef

cyrusyc commited on Jul 28, 2024

improve stability visualization; update leaderborad

3b3aaa9

cyrusyc commited on Jul 16, 2024

refactor external calculators; better handle devices

7cbf186

cyrusyc commited on Jul 8, 2024