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@lsmo-epfl

lsmo-epfl

Laboratory for Molecular Simulation, EPFL

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  1. aiida-raspa aiida-raspa Public

    The RASPA plugin for the AiiDA workflow and provenance engine. http://www.aiida.net

    Python 11 8

  2. zeopp-lsmo zeopp-lsmo Public

    Forked from mharanczyk/zeoplusplus

    zeo++ fork of the LSMO

    C++ 9 1

  3. aiida-lsmo aiida-lsmo Public

    AiiDA workflows for the LSMO laboratory at EPFL

    Python 8 13

  4. aiida-zeopp aiida-zeopp Public

    AiiDA plugin for zeo++

    Python 5 8

  5. EQeq EQeq Public

    Forked from danieleongari/EQeq

    Charge equilibration method for crystal structures

    C++ 3 2

  6. aiida-qeq aiida-qeq Public

    AiiDA plugin for computing electronic charges on atoms using equilibration-type models (QEq, EQEq, ...).

    Python 2 2

Repositories

Showing 10 of 13 repositories
  • EQeq Public Forked from danieleongari/EQeq

    Charge equilibration method for crystal structures

    lsmo-epfl/EQeq’s past year of commit activity
    C++ 3 GPL-2.0 15 5 0 Updated Jul 18, 2024
  • ch420 Public

    Resources for course CH-420 Understanding Advanced Molecular Simulation

    lsmo-epfl/ch420’s past year of commit activity
    Jupyter Notebook 1 1 1 0 Updated Apr 30, 2024
  • ch-315 Public
    lsmo-epfl/ch-315’s past year of commit activity
    Jupyter Notebook 0 MIT 1 0 0 Updated Sep 27, 2023
  • aiida-lsmo Public

    AiiDA workflows for the LSMO laboratory at EPFL

    lsmo-epfl/aiida-lsmo’s past year of commit activity
    Python 8 13 3 7 Updated Sep 8, 2023
  • aiida-qeq Public

    AiiDA plugin for computing electronic charges on atoms using equilibration-type models (QEq, EQEq, ...).

    lsmo-epfl/aiida-qeq’s past year of commit activity
    Python 2 MIT 2 1 0 Updated Sep 6, 2023
  • aiidalab-epfl-lsmo Public
    lsmo-epfl/aiidalab-epfl-lsmo’s past year of commit activity
    Jupyter Notebook 0 7 3 0 Updated Sep 6, 2023
  • aiida-zeopp Public

    AiiDA plugin for zeo++

    lsmo-epfl/aiida-zeopp’s past year of commit activity
    Python 5 8 1 0 Updated Aug 27, 2023
  • aiida-raspa Public

    The RASPA plugin for the AiiDA workflow and provenance engine. http://www.aiida.net

    lsmo-epfl/aiida-raspa’s past year of commit activity
    Python 11 8 7 1 Updated Aug 27, 2023
  • aiida-ddec Public

    AiiDA plugin for the DDEC code

    lsmo-epfl/aiida-ddec’s past year of commit activity
    Python 1 MIT 7 2 0 Updated Aug 27, 2023
  • zeopp-lsmo Public Forked from mharanczyk/zeoplusplus

    zeo++ fork of the LSMO

    lsmo-epfl/zeopp-lsmo’s past year of commit activity
    C++ 9 4 3 2 Updated Dec 19, 2022
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