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MineralsCloud / qha

A Python package for calculating thermodynamic properties under quasi-harmonic approximation, using data from ab-initio calculations
https://mineralscloud.github.io/qha/
GNU General Public License v3.0
27 stars 13 forks source link

Dependencies resolve #75

Open singularitti opened 5 years ago

singularitti commented 5 years ago

Use poetry to generate a pyproject.toml. Fix dependencies versions on every build.