CALPHAD tools for designing thermodynamic models, calculating phase diagrams and investigating phase equilibria.
Fitting thermodynamic models with pycalphad.
XML database plugin for pycalphad
Metapackage for Materials Genome Foundation projects
Density functional theory workflows for finite temperature thermodynamics based on atomate workflows. Created by the Phases Research Lab
Scheil-Gulliver simulations using pycalphad.
pysqs calculates simple quasirandom structures
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