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XML Schema validator and data conversion library for Python
CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.
Open Calphad, thermodynamic calculation code
A library of ultrasoft and PAW pseudopotentials
Thermo_pw is a driver of quantum-ESPRESSO routines for the automatic computation of ab-initio material properties.
Packet capture sanitizer/anonymizer.
A python project for quasi-harmonic properties calculations
A C++ project for thermodynamic calculations