Tutorials

Below are the currently available examples:

Examples:

• Fe₃Pt: Example of applying zentropy to the 3 lowest energy configurations in Fe₃Pt 12-atom supercell. The Helmholtz energies were calculated using the energy–volume curves and the Debye–Grüneisen model.

The Jupyter notebooks are located in examples/codespace and can be run using GitHub Codespaces or locally in your preferred IDE (e.g., VS Code).