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deepmodeling / dpdata Public

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fix bug for duplicated header cp2k output#233

Merged

wanghan-iapcm merged 2 commits into

deepmodeling:develdeepmodeling/dpdata:develfrom

robinzyb:develCopy head branch name to clipboard

Dec 6, 2021

Conversation Commits2 (2)Checks Files changed

Merged

fix bug for duplicated header cp2k output#233
wanghan-iapcm merged 2 commits into
deepmodeling:develfrom
robinzyb:devel

Commits

Commits on Dec 6, 2021

fix bug: nonconverged cp2k ouput should return None virial
robinzyb
committed
fix bug for duplicated header cp2k output
robinzyb
committed

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