v0.3.3
What's Changed
- fixing which_bonds by @JonasGrandel in #168
- fix createinputs alias not working, update test for the same by @naik-aakash in #171
- Automatic orbital wise analysis functionality in analyze module by @naik-aakash in #132
- Replace unittests with pytests + update CI workflow and code doc-strings by @naik-aakash in #177
- replace get_anion_types with anion_types by @naik-aakash in #174
- rename keys of calc quality summary and snake_case by @naik-aakash in #178
- Remove read the docs config by @naik-aakash in #182
- Refactor cli.py for cleaner options on cli help by @naik-aakash in #172
- overwrite add_cohp for interactive plotter > Now it works as expected by @naik-aakash in #176
- Extend featurizer by @naik-aakash in #179
- Update README.md by @naik-aakash in #184
- Increase test coverage by @naik-aakash in #185
- add POSCAR.lobster support in featurizer by @naik-aakash in #186
New Contributors
- @JonasGrandel made their first contribution in #168
Full Changelog: v0.3.2...v0.3.3