setuptools
setuptools_scm
wheel
pymatgen>2022.11.7
numpy
sympy
scipy
tqdm
hsnf>=0.3.15
pyzdd==0.2.8

[dev]
ipython
notebook
jupyter_contrib_nbextensions
matplotlib
seaborn
pandas
pytest>=6.0.0
pytest-cov
pytest-benchmark
pre-commit
black
flake8
mypy
isort
pyupgrade

[docs]
sphinx
sphinx-autobuild
nbsphinx==0.9.3
myst-parser
sphinx-book-theme
ipykernel
