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Clarify cp2k prints 4 of 4 checklist items completed!3347updated
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MAINT: Fix `pytest.PytestRemovedIn9Warning` since pytest 8.2.0 1 of 1 checklist item completed!3346
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BUG: aims parser for spin coll. calculation + MD_light 2 of 4 checklist items completed
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Draft: More flexible command handling 0 of 4 checklist items completed!3343
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non collinear magmom and magmoms for vasp outcar 2 of 4 checklist items completed!3342
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Add ability to send positions to CP2K via file 6 of 6 checklist items completed!3341
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!3340
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Implement arbitrary k-points for espresso calculator 4 of 4 checklist items completed!3339
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BUG: avoid parsing unsupported singlepoint properties 2 of 4 checklist items completed!3338
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Add Vaspsol++ Inputs to vasp calculator 2 of 4 checklist items completed!3337
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Fix 3d-phasediagram code for decompose method 4 of 4 checklist items completed!3336
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Fix bz_plot testing 4 of 4 checklist items completed!3335updated
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DOC: Expand docs for atoms.ratttle to explain seed. 2 of 2 checklist items completed!3334
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DOC: Small update to velocity distro docstrings. 2 of 2 checklist items completed!3333
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Parse atomic charges in `read_gaussian_out` 4 of 4 checklist items completed!3332
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💡 succeed in generating pdf 2 of 4 checklist items completed!3330
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Update cell's __array__ signature for numpy2 0 of 4 checklist items completed!3329 numpy-2
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Add calc.write for DFTD3 3 of 4 checklist items completed!3328