Related Issues (20)
- OptimadeRester HOT 14
- Overlayed subplots from `BSPlotterProjected.get_projected_plots_dots()` and `get_projected_plots_dots_patom_pmorb()` HOT 1
- `atom_site_label` in CIF file are not unique HOT 10
- CrystalNN gives incorrect result for simple aromatic ring HOT 13
- ChemEnv unable to identify the environments of supercell HOT 7
- Atom labels in CIF file are silently rewritten by CifWriter HOT 6
- Collect possible issues might come with Python 3.12
- Periodic boundary condition is not considered in the interpolator of VolumetricData HOT 1
- [Dev] `datetime.datetime.utcnow()` deprecated and replacement breaks `strptime`
- Read in POSCAR with `Structure.from_file` seems slow? HOT 3
- `get_points_in_sphere()` has inconsistent return types HOT 1
- Monthly issue metrics report
- StructureMatcher might be wrong when used to check if two structures are equal. HOT 3
- Error in CP2K output parser structure parsing
- Bug in `core.composition` comparison
- Argument `check_occu` is not working as intended (in `_get_structure` and `parse_structures`) HOT 15
- Check inputs provided to MPRester functions
- `.as_dict()` method on `VaspInput` causes an `AttributeError`
- A minor document error in `POTCAR Setup`.
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