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fix-nwchem-test
254661d4
·
Add docstrings
·
Nov 03, 2025
master
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protected
83a683b9
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Merge branch 'move-atoms-and-calculator-to-sphinx' into 'master'
·
Nov 03, 2025
history
553eff64
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Reformat with default Ruff settings
·
Nov 03, 2025
mysiesta
fe856452
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ifxed write_input
·
Oct 30, 2025
macos_testsuite_errors
a79d318d
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Reformat by ruff.
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Oct 28, 2025
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cp2k_bandstructure
7277cbce
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Implement bare minimum for band structure calculation
·
Nov 01, 2016
hide-search
31540d40
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first commit
·
Dec 07, 2016
fix_wannier
68e1d24b
·
Fix writing Wannier functions to file
·
Dec 15, 2016
more_robust_spacegroup
cae9b891
·
Removed unnessesary float convertions
·
Jan 12, 2017
phonon_write
ec9185dc
·
Filename should be first argument
·
Feb 22, 2017
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