spglib>=2.5.0
numpy
scipy
pymatgen>=2024.1.26
inflect
networkx
matminer>=0.9.2
monty
pubchempy
pybtex

[cli]
mp_api

[dev]
tqdm
pybel
pebble
maggma

[docs]
sphinx>=5.3.0
sphinx-argparse==0.5.2
sphinx_rtd_theme==3.0.2
sphinx-autodoc-typehints==3.0.1

[lint]
coverage==7.11.0
codacy-coverage==1.3.11
pycodestyle==2.14.0
mypy==1.18.2
pydocstyle==6.1.1
flake8==7.3.0
pylint==4.0.2
black==25.9.0

[strict]
spglib==2.6.0
numpy==2.2.6
scipy==1.15.3
pymatgen==2025.10.7
inflect==7.5.0
networkx==3.4.2
matminer==0.9.3
monty==2025.3.3
pubchempy==1.0.5
pybtex==0.25.1

[tests]
pytest
pytest-cov
pytest-xdist
