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mlip-arena / mlip_arena /models /utils.py

Commit History

Add Widom insertion (#34)
072f65e

Yuan (Cyrus) Chiang hspark1212 commited on

more logger; fix relaxation filter
df7cf57

cyrusyc commited on

Add `eqV2_86M_omat_mp_salex` model (#14)
a133fcb

Yuan (Cyrus) Chiang commited on

restrict mace version, update eos test
b6e35d7

cyrusyc commited on

refactor external calculators; better handle devices
5d9e01e

cyrusyc commited on

add alignn
5f78296

cyrusyc commited on

update before hf
a140ef6

cyrusyc commited on

updates before modification
5f464b3

cyrusyc commited on

improve class defintion and new task
d98d701

cyrusyc commited on