.gitignore
.pre-commit-config.yaml
MANIFEST.in
Makefile
README.md
README.rst
make.bat
pyproject.toml
requirements-ci.txt
requirements.txt
setup.cfg
setup.py
.github/workflows/testing.yml
.github/workflows/update-precommit.yml
.vscode/settings.json
dash_app/chempot_selection.py
dash_app/formation_en_Mn_Ga.json
docs/admin/version-releases.md
docs/src/changelog.rst
docs/src/conf.py
docs/src/contributing.rst
docs/src/index.rst
docs/src/_static/custom.css
docs/src/_static/orcid.svg
docs/src/_static/fonts/lato-bold-italic.woff
docs/src/_static/fonts/lato-bold-italic.woff2
docs/src/_static/fonts/lato-bold.woff
docs/src/_static/fonts/lato-bold.woff2
docs/src/_static/fonts/lato-normal-italic.woff
docs/src/_static/fonts/lato-normal-italic.woff2
docs/src/_static/fonts/lato-normal.woff
docs/src/_static/fonts/lato-normal.woff2
docs/src/_static/img/simple_flow.png
docs/src/_templates/breadcrumbs.html
pymatgen/analysis/defects2/__init__.py
pymatgen/analysis/defects2/_version.py
pymatgen/analysis/defects2/ccd.py
pymatgen/analysis/defects2/core.py
pymatgen/analysis/defects2/corrections.py
pymatgen/analysis/defects2/finder.py
pymatgen/analysis/defects2/generators.py
pymatgen/analysis/defects2/supercells.py
pymatgen/analysis/defects2/thermo.py
pymatgen/analysis/defects2/utils.py
pymatgen_analysis_defects.egg-info/PKG-INFO
pymatgen_analysis_defects.egg-info/SOURCES.txt
pymatgen_analysis_defects.egg-info/dependency_links.txt
pymatgen_analysis_defects.egg-info/requires.txt
pymatgen_analysis_defects.egg-info/top_level.txt
source/conf.py
source/index.rst
tests/__init__.py
tests/conftest.py
tests/test_ccd.py
tests/test_core.py
tests/test_finder.py
tests/test_generators.py
tests/test_supercells.py
tests/test_thermo.py
tests/test_files/GaN.vasp
tests/test_files/stable_entries_Mg_Ga_N.json
tests/test_files/Mg_Ga/bulk_sc/LOCPOT.gz
tests/test_files/Mg_Ga/bulk_sc/vasprun.xml.gz
tests/test_files/Mg_Ga/q=-1/LOCPOT.gz
tests/test_files/Mg_Ga/q=-1/vasprun.xml.gz
tests/test_files/Mg_Ga/q=-2/LOCPOT.gz
tests/test_files/Mg_Ga/q=-2/vasprun.xml.gz
tests/test_files/Mg_Ga/q=0/LOCPOT.gz
tests/test_files/Mg_Ga/q=0/vasprun.xml.gz
tests/test_files/Mg_Ga/q=1/LOCPOT.gz
tests/test_files/Mg_Ga/q=1/vasprun.xml.gz