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leseixas/README.md

Leandro Seixas, PhD

Why can materials mix to form alloys?

To answer this and understand how alloys are formed, I am using artificial intelligence, quantum mechanics, and a lot of computational physics.


Research Fellow at Instituto de Física Teórica, UNESP 🇧🇷
seixas.tech
LinkedIn

Main projects

Project Description
quasigraph Graph-like chemical and geometric descriptor toolkit for studying materials with machine learning models
blendpy Computational toolkit for investigating thermodynamic models of alloys using first-principles calculations

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  1. quasigraph quasigraph Public

    Graph-like chemical and geometric descriptor toolkit for studying materials with machine learning models.

    Python 3 1

  2. blendpy blendpy Public

    Computational toolkit for investigating thermodynamic models of alloys using first-principles calculations

    Python 1

  3. fastatoms fastatoms Public

    Python 1

  4. fastelectrons fastelectrons Public

    Python 1

  5. aprendizagem-de-maquina aprendizagem-de-maquina Public

    Arquivos do tutorial de aprendizagem de máquina (curso em português)

    Jupyter Notebook

  6. QM9_to_ASE_parser QM9_to_ASE_parser Public

    Python