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Please also check gitlab.com/sirmarcel
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Please also check gitlab.com/sirmarcel
60 followers · 23 following

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Achievement: Pair ExtraordinaireAchievement: Pull Sharkx2Achievement: QuickdrawAchievement: StarstruckAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pair ExtraordinaireAchievement: Pull Sharkx2Achievement: QuickdrawAchievement: StarstruckAchievement: Arctic Code Vault Contributor

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sirmarcel/README.md

Hello! 👋

I'm Marcel, a postdoc in the COSMO Lab at EPFL in Lausanne, Switzerland. Previously, I was a doctoral student at the Fritz Haber Institute (in the NOMAD Laboratory) and TU Berlin (in the Machine Learning group).

I work on applying machine learning to materials science problems. Recently, I've particularly focused on machine-learning potentials, and wrote a bunch of packages, linked below, to support this research. Most of them use jax.

Here are some other places on the internet you can have a look at:

Thanks for stopping by 🚀

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  1. glp glp Public

    tools for graph-based machine-learning potentials in jax

    Python 18 2

  2. lab-cosmo/jax-pme lab-cosmo/jax-pme Public

    Particle-mesh based calculations of long-range interactions in JAX

    Python 12

  3. gkx gkx Public

    Green-Kubo + JAX + MLPs = Anharmonic Thermal Conductivities Done Fast

    Python 5

  4. renderables renderables Public

    build your own static site generator

    Python 1

  5. doctor-archive doctor-archive Public

    my dissertation

    TeX 4

  6. eqt-archive eqt-archive Public

    data and code for "Probing the effects of broken symmetries in machine learning"

    Jupyter Notebook 1