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
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Adding an all-in-one CLI #40

Closed chazeon closed 6 years ago

chazeon commented 6 years ago

Fixes #36

Proposed Changes

Further improvements