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@numfocus @MicrosoftResearch @microsoft @conda-forge @dftbplus @spack @lfortran @dftd4 @grimme-lab @fortran-lang @qcxms @toml-f @tbmalt @tblite @crest-lab @dftbparams @dftd3

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awvwgk/README.md

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  1. microsoft/skala microsoft/skala Public

    Skala exchange-correlation functional

    Python 193 24

  2. grimme-lab/xtb grimme-lab/xtb Public

    Semiempirical Extended Tight-Binding Program Package

    Fortran 770 187

  3. tblite/tblite tblite/tblite Public

    Light-weight tight-binding framework

    Fortran 192 60

  4. fortran-lang/fpm fortran-lang/fpm Public

    Fortran Package Manager (fpm)

    Fortran 1k 132

  5. dftd4/dftd4 dftd4/dftd4 Public

    Generally Applicable Atomic-Charge Dependent London Dispersion Correction

    Fortran 208 61

  6. toml-f/toml-f toml-f/toml-f Public

    TOML parser implementation for data serialization and deserialization in Fortran

    Fortran 125 32