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Add support for NPT_F AIMD of cp2k version 7.1 #33

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merged 3 commits into from
Dec 26, 2023
Merged

Add support for NPT_F AIMD of cp2k version 7.1 #33

merged 3 commits into from
Dec 26, 2023

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robinzyb
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@robinzyb robinzyb added the Enhancement New feature or request label Dec 26, 2023
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coveralls commented Dec 26, 2023 •
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Pull Request Test Coverage Report for Build 7330398212

  • 11 of 17 (64.71%) changed or added relevant lines in 2 files are covered.
  • No unchanged relevant lines lost coverage.
  • Overall coverage increased (+1.3%) to 38.584%
Changes Missing Coverage Covered Lines Changed/Added Lines %
cp2kdata/output.py 4 6 66.67%
cp2kdata/block_parser/cells.py 7 11 63.64%
Totals Coverage Status
Change from base Build 7200732113: 1.3%
Covered Lines: 752
Relevant Lines: 1949
💛 - Coveralls

@robinzyb robinzyb merged commit 39b268f into main Dec 26, 2023
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