- 09 May, 2016 1 commit
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Lauri Himanen authored
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- 28 Apr, 2016 1 commit
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Lauri Himanen authored
Added parsing for external force file, added detection of CP2K run mode and optimization based on it, started working on GEO_OPT parsing.
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Added parsing for external force file, added detection of CP2K run mode and optimization based on it, started working on GEO_OPT parsing.