ase
aiida-core>=2.6
aiida-gui-apps

[docs]
sphinx_rtd_theme
sphinx~=7.2
sphinx-copybutton~=0.5.0
sphinx-design~=0.5.0
sphinx-notfound-page~=1.0
sphinxext-rediraffe~=0.2.4
sphinx-intl~=2.1.0
sphinx-gallery
myst-nb~=1.0.0
nbsphinx

[pre-commit]
pre-commit~=2.2
pylint~=2.17.4
