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materialsproject / pymatgen

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials …

Python 1,909 953 Updated Jun 12, 2026

jeanwsr / S-O-MQC-HW

Solutions for Modern Quantum Chemistry, Szabo & Ostlund

TeX 103 17 Updated Feb 16, 2025

ArunKantholi / Complete-Python-3-Bootcamp

Forked from Pierian-Data/Complete-Python-3-Bootcamp

Course Files for Complete Python 3 Bootcamp Course on Udemy

Jupyter Notebook 1 Updated Sep 24, 2023