ase>3.22.1
cclib>=1.8
custodian>=2023.6.5
emmet-core>=0.69.6
maggma>=0.57.0
monty>=2023.9.25
numpy>=1.25.0
psutil
pydantic>=2.0.1
pydantic-settings>=2.0.3
pymatgen>=2023.10.4
typer>=0.9.0

[covalent]
covalent>=0.226.0rc0
covalent-hpc-plugin>=0.0.3

[dask]
dask[distributed]>=2023.12.0
dask-jobqueue>=0.8.2

[defects]
pymatgen-analysis-defects>=2023.8.22
shakenbreak>=3.2.0

[dev]
black>=23.7.0
codecov-cli>=0.4.1
isort>=5.12.0
pytest>=7.4.0
pytest-cov>=3.0.0
ruff>=0.0.285

[docs]
blacken-docs>=1.16.0
mkdocs-material>=9.1.21
mkdocstrings[python]>=0.22.0
mkdocs-gen-files>=0.5.0
mkdocs-literate-nav>=0.6.0
pillow>=10.0.0
cairosvg>=2.7.1

[jobflow]
jobflow>=0.1.14
fireworks>=2.0.3

[newtonnet]
newtonnet>=1.1

[parsl]
parsl[monitoring]>=2023.10.23

[phonons]
phonopy>=2.20.0

[prefect]
prefect>=2.13.1
prefect-dask>=0.2.4
dask-jobqueue>=0.8.2

[redun]
redun>=0.16.2

[sella]
sella>=2.3.2

[tblite]

[tblite:platform_system == "Linux"]
tblite[ase]>=0.3.0
