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    5 repositories

    • odbx.science

      Public
      An OPTIMADE implementation for @AJMGroup using https://github.com/Materials-Consortia/optimade-python-tools
      Python
      •3•0•0•7•Updated Mar 1, 2023Mar 1, 2023

    • matador

      Public
      ⚗️ matador is an aggregator, manipulator and runner of first-principles calculations, written with a bent towards battery 🔋 electrode materials.
      Python
      •
      MIT License
      •20•0•0•24•Updated Jan 1, 2023Jan 1, 2023

    • optados

      Public
      Official Repository of the Optados code
      Fortran
      •24•0•0•0•Updated Jul 19, 2021Jul 19, 2021

    • data.copper-phosphides

      Public
      This repository accompanies the paper Computational Investigation of Copper Phosphides as Conversion Anodes for Lithium-Ion Batteries by Angela Harper, Matthew …
      Jupyter Notebook
      •
      MIT License
      •2•0•0•0•Updated Jul 28, 2020Jul 28, 2020

    • ilustrado

      Public
      High-throughput crystal structure prediction with genetic algorithms.
      Python
      •
      MIT License
      •3•0•0•0•Updated Jul 2, 2020Jul 2, 2020
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