pymatgen-analysis-alloys Library

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library 0.0.8 ·python
verified May 26, 2026

pymatgen-analysis-alloys is an add-on library for Pymatgen, providing classes and tools specifically designed for describing alloy (disordered) systems. It extends Pymatgen's core functionalities to handle compositions and structures where atomic sites may be occupied by multiple species with certain probabilities. The current version is 0.0.8, and releases are generally tied to new features or compatibility updates within the broader Pymatgen ecosystem.

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