pymatgen-core>=2026.4.16

[abinit]
netcdf4>=1.7.2

[ase]
ase>=3.23.0

[matcalc]

[matcalc:python_version < "3.13"]
matcalc>=0.4.0
matgl>=2.0.4

[mlp]

[mlp:python_version < "3.13"]
matgl>=2.0.4

[numba]
numba>=0.55

[numpy-v1]

[numpy-v1:python_version < "3.13"]
numpy<2,>=1.25.0

[optional]
pymatgen[abinit,ase,matcalc,mlp,tblite,zeopp]
beautifulsoup4
pymatgen-analysis-alloys
chemview>=0.6
f90nml>=1.1.2
galore>=0.6.1
h5py>=3.11.0
hiphive>=1.3.1
jarvis-tools>=2020.7.14
phonopy>=2.33.3
seekpath>=2.0.1

[prototypes]
pyxtal>=1.0
pymatgen[symmetry]

[symmetry]
moyopy[interface]>=0.3
spglib>=2.5

[tblite]

[tblite:platform_system == "Linux" and python_version < "3.12"]
tblite[ase]>=0.3.0

[vis]
vtk>=9.6.0

[zeopp]

[zeopp:platform_system != "Windows"]
pyzeo
