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@aiidateam @Materials-Consortia @materialscloud-org @aiidalab @nanotech-empa

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  1. phase-field-crystal-mpi phase-field-crystal-mpi Public

    Phase-field crystal solidification simulation codes (mpi C++ and python)

    Python 32 13

  2. dealii-field-currents-heating dealii-field-currents-heating Public

    FEM code for electric field, electric currents and heating calculations

    C++ 7 2

  3. tb-mean-field-hubbard tb-mean-field-hubbard Public

    Python code for solving the tight-binding mean field Hubbard hamiltonian

    Python 13 1

  4. nanotech-empa/cp2k-spm-tools nanotech-empa/cp2k-spm-tools Public

    Scanning probe microscopy simulation tools based on CP2K

    Python 14 5

  5. nanotech-empa/aiida-gaussian nanotech-empa/aiida-gaussian Public

    AiiDA plugin for Gaussian quantum chemistry software

    Python 12 3

  6. Materials-Consortia/optimade-maker Materials-Consortia/optimade-maker Public

    Tools for making OPTIMADE APIs from various formats of structural data (e.g. an archive of CIF files).

    Python 6 2