setuptools
wheel
pymatgen>=2025.3.10
pytest>=8.3.5
juliacall>=0.9.24
vesin>=0.3.2
ase>=3.24.0

[dev]
bumpver
ruff

[docs]
sphinx
pip
furo
nbsphinx
ipython
pyzmq
sphinx-autoapi
sphinx-autobuild
pydata_sphinx_theme
sphinxext-opengraph
sphinx-copybutton
sphinx-design
jupyter_sphinx
sphinx-togglebutton
sphinx_favicon
sphinx_sitemap

[numba]
numba>=0.63.1

[publish]
build
twine

[tests]
pytest
pytest-cov
