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Home / Topics / materials-science

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Top MATERIALS-SCIENCE GitHub Repositories & Tools (2026)

Discover the most starred and trending open source tools tagged with #materials-science.

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5 matching projects · updated Sep 30, 2026 How we rank ↗

#1 TRENDING materialyzeai/matgl Python 2022

Graph deep learning library for materials

◇ deep ◇ graph ◇ learning ◇ materials-informatics

121 ↑ +1 today

576

#2 TRENDING Quantum-Accelerators/quacc Python 2021

quacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.

◇ chemistry ◇ computational-materials-science ◇ database ◇ dft

80 ↑ +1 today

294

#3 TRENDING seto77/ReciPro C# 2019

The software ReciPro makes various crystallographic calculations, visualizes a crystal structure, simulates diffraction patterns and TEM image, indexes diffraction spots, plots stereographic projection, and so on.

◇ alchemi ◇ bloch-wave ◇ cbed ◇ cif

14 ↑ +1 today

190