aiida-core~=1.1
pycifrw~=4.2
pymatgen
voluptuous

[pre-commit]
pre-commit==2.0.1
six>=1.12.0
yapf==0.28.0
prospector==1.2.0
pylint==2.4.4

[testing]
pgtest~=1.2.0
pytest<5.0.0,>=4.4
pytest-cov<3.0.0,>=2.6.1
coverage
ase~=3.15
