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atomind
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mlip-arena
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e80e29d
mlip-arena
/
tests
4 contributors
History:
29 commits
Yuan (Cyrus) Chiang
promote run deps, bump prefect and mace versions (#40)
ccfdb25
unverified
17 days ago
test_elasticity.py
Safe
1.22 kB
Add elasticity task (#37)
about 1 month ago
test_eos.py
Safe
1.84 kB
promote run deps, bump prefect and mace versions (#40)
17 days ago
test_external_calculators.py
Safe
1.51 kB
Add MatterSim (#25)
about 2 months ago
test_md.py
Safe
654 Bytes
Return equilibrium volume and energy from EOS task (#29)
about 1 month ago
test_neb.py
Safe
1.16 kB
Add neb task (#38)
about 1 month ago
