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pycalphad 0.11.3.dev43+g0cbc613c0 documentation
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pycalphad 0.11.3.dev43+g0cbc613c0 documentation
  • Install PyCalphad
  • Release Notes

How-to

  • Phase Diagrams
    • Plotting Isobaric Binary Phase Diagrams with binplot
    • Plotting Ternary Phase Diagrams and Using Triangular Axes
    • Plotting using the Mapping API
    • Phases with Electrically Charged Species
  • Computing Properties
    • Phase Fractions and Phase Compositions vs Temperature
    • Gibbs Energy of Each Phase at Fixed Composition
    • Heat Capacity of Cementite (\(Fe_3C\))
    • Equilibrium Properties and Partial Ordering (Al-Fe and Al-Ni)
    • Custom Models in pycalphad: Viscosity
    • Calculating Energy Surfaces [Legacy Method]
  • High Throughput Analysis
    • High-throughput Calculations
    • Exploring calculate and equilibrium xarray Datasets
    • Screening for Phase Stability
  • Metastability and Reference States
    • Calculations with Reference States
    • Metastability calculations
    • Calculate and Plot Activity
    • Special _MIX Reference State

Reference

  • Calphad Databases
  • FAQ

Developer

  • Releasing PyCalphad
  • Onboarding as a Developer
  • Contributing to PyCalphad
  • API Documentation
    • pycalphad package
      • pycalphad.codegen package
      • pycalphad.core package
      • pycalphad.io package
      • pycalphad.mapping package
        • pycalphad.mapping.strategy package
      • pycalphad.models package
      • pycalphad.plot package
        • pycalphad.plot.binary package
      • pycalphad.property_framework package
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