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[WIP] Atomate2 deprecation #31
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qchempku2017
merged 16 commits into
CederGroupHub:main
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qchempku2017:atomate2_deprecation
Sep 14, 2023
Merged
[WIP] Atomate2 deprecation #31
qchempku2017
merged 16 commits into
CederGroupHub:main
from
qchempku2017:atomate2_deprecation
Sep 14, 2023
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… test_unfreeze in test_mc_generators.py.
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Summary
Additional dependencies introduced (if any)
TODO (if any)
Checklist
Run pycodestyle and flake8
on your local machine.
Run pydocstyle on your code.