mlip-arena / tests /test_eos.py

Commit History

Allow fine grained intermediate cache for optimization in EOS task (#35)
b7a7786
unverified

Yuan (Cyrus) Chiang commited on

High-throughput EOS flow on alloy systems (#30)
1d1ee87
unverified

Yuan (Cyrus) Chiang commited on

Return equilibrium volume and energy from EOS task (#29)
08a88d8
unverified

Yuan (Cyrus) Chiang commited on

refactor eos into task (#28)
51638da
unverified

Yuan (Cyrus) Chiang commited on

test md
4817e63

cyrusyc commited on

avoid align test failuare due to poor download design
e59afe6

cyrusyc commited on

Add `eqV2_86M_omat_mp_salex` model (#14)
52c1bfb
unverified

Yuan (Cyrus) Chiang commited on

enable eos test
6627261

cyrusyc commited on

add eos notebook
c7922c2

cyrusyc commited on

minor cleanup
5b87ae4

cyrusyc commited on

add pytest skip reason
be3a290

cyrusyc commited on

test eos on only 3.11
4cf73ad

cyrusyc commited on

refactor test eos
c3e45ae

cyrusyc commited on

restrict mace version, update eos test
79e5bd9

cyrusyc commited on

verbose test
18d7cd4

cyrusyc commited on

add relax task, eos workflow, and prefect test
1effaf5

cyrusyc commited on