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@janssenlab

janssenlab

Materials Informatics Group at the Max Planck Institute for Sustainable Material
README.md

Janssen Lab

Software developed in the Materials Informatics group at the Max Planck Institute for Sustainable Materials.

Project Description Coverage Github Stars
pyiron/executorlib (since 2025) Up-scale python functions for HPC codecov GitHub Repo stars
pyiron/pyiron (2015-2025) Atomistic development environment GitHub Repo stars
pythonworkflow/python-workflow-definition Workflow interoperability standard codecov GitHub Repo stars
jan-janssen/LangSim LLM Agents for Atomistic Simulation GitHub Repo stars
pyiron/pylammpsmpi Parallel Lammps Python interface codecov GitHub Repo stars
pyiron/pysqa Simple HPC queuing system adapter codecov GitHub Repo stars

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  1. 2024-SusMet-Density-Functional-Theory-Lecture 2024-SusMet-Density-Functional-Theory-Lecture Public archive

    Supplementary Information for the Lecture on Density Functional Theory Lecture

    Jupyter Notebook 1

  2. 2025-SusMet-Machine-Learning-Workshop 2025-SusMet-Machine-Learning-Workshop Public archive

    SusMet Machine Learning Workshop Material

    Jupyter Notebook 1

  3. 2025-Birmingham-University-Atomistic-Simulation-Lecture 2025-Birmingham-University-Atomistic-Simulation-Lecture Public archive

    Supplementary information for the lecture at the university of Birmingham.

    Jupyter Notebook 1 1

  4. 2025-RUB-Programming-Concepts-in-Materials-Science-Lecture 2025-RUB-Programming-Concepts-in-Materials-Science-Lecture Public archive

    Programming Concepts in Materials Science - Introduction to Python

    Jupyter Notebook 1

  5. .github .github Public

    The Materials Informatics group lead by Dr. Jan Janssen at the Max Planck Institute for Sustainable Materials.

    1

Repositories

Showing 5 of 5 repositories

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