pymatgen
Materials science toolkit. Crystal structures (CIF, POSCAR), phase diagrams, band structure, DOS, Materials Project integration, format conversion, for computational materials science.
Details
- Path
- skills/pymatgen
- License
- MIT license
- Bundled scripts
- 3
- Dependencies
- 3
Bundled scripts
- skills/pymatgen/scripts/structure_analyzer.py
- skills/pymatgen/scripts/structure_converter.py
- skills/pymatgen/scripts/phase_diagram_generator.py