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fix double count bug#107

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amcadmus merged 1 commit into
deepmodeling:develfrom
robinzyb:devel
Aug 2, 2020
Merged

fix double count bug#107
amcadmus merged 1 commit into
deepmodeling:develfrom
robinzyb:devel

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@robinzyb

@robinzyb robinzyb commented Aug 1, 2020

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Fix the bug for double counting coordination information.
The fp job which is stop once and restart in dpgen will print double head information. The cp2k parser will double count coordination information.
A double head cp2k output is created to exam the robustness of parser

@amcadmus amcadmus merged commit 572c004 into deepmodeling:devel Aug 2, 2020
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