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atomind
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mlip-arena
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00b56e2
mlip-arena
/
tests
4 contributors
History:
28 commits
Yuan (Cyrus) Chiang
Add neb task (#38)
e59bc30
unverified
about 1 month ago
test_elasticity.py
Safe
1.22 kB
Add elasticity task (#37)
about 1 month ago
test_eos.py
Safe
1.86 kB
Allow fine grained intermediate cache for optimization in EOS task (#35)
about 2 months ago
test_external_calculators.py
Safe
1.51 kB
Add MatterSim (#25)
2 months ago
test_md.py
Safe
654 Bytes
Return equilibrium volume and energy from EOS task (#29)
about 2 months ago
test_neb.py
Safe
1.16 kB
Add neb task (#38)
about 1 month ago
