aiida-core<2.0.0,>=1.1.0
aiida-quantumespresso~=3.4
aiida-codtools~=2.1
aiida-optimize~=0.4
numpy
ase~=3.20
seekpath~=1.9
importlib-resources~=3.3
voluptuous

[docs]
sphinx~=3.2.1
sphinx-copybutton~=0.3.0
sphinx-book-theme~=0.1.0
sphinx-autoapi~=1.8.1
sphinx-click~=2.7.1

[pre-commit]
mypy==0.790
pre-commit~=2.2
pylint~=2.7.0

[tests]
pgtest~=1.3
pytest~=6.0
pytest-regressions~=1.0
