numpy>=2.0
ase>=3.25
pymatgen>=2024.8
ipdb
cvxpy>=1.6
phonopy>=2.42
seekpath>=2.1
pulp>=3.3
scikit-learn>=1.6.1

[dev]
pretty-errors>=1.2.25
pytest>=8.4.2
pytest-cov>=7.1.0
pytest-datadir>=1.8.0
