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Achievements

Achievement: Pair Extraordinairex4Achievement: YOLOAchievement: Pull Sharkx4Achievement: QuickdrawAchievement: Starstruckx3Achievement: Mars 2020 ContributorAchievement: Arctic Code Vault Contributor

Achievements

Achievement: Pair Extraordinairex4Achievement: YOLOAchievement: Pull Sharkx4Achievement: QuickdrawAchievement: Starstruckx3Achievement: Mars 2020 ContributorAchievement: Arctic Code Vault Contributor

Organizations

@psi4@openforcefield@PyQC

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Pinned Loading

  1. psi4/psi4psi4/psi4Public

    Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python

    C++ 1.2k 505

  2. opt_einsumopt_einsumPublic

    ⚡️Optimizing einsum functions in NumPy, Tensorflow, Dask, and more with contraction order optimization.

    Python 989 75

  3. MolSSI/QCFractalMolSSI/QCFractalPublic

    A distributed compute and database platform for quantum chemistry.

    Python 166 55

  4. psi4/psi4numpypsi4/psi4numpyPublic

    Combining Psi4 and Numpy for education and development.

    Jupyter Notebook 397 170

  5. MolSSI/cookiecutter-cmsMolSSI/cookiecutter-cmsPublic

    Python-centric Cookiecutter for Molecular Computational Chemistry Packages

    Python 460 93

  6. psi4/gau2gridpsi4/gau2gridPublic

    Fast computation of a gaussian and its derivative on a grid.

    Python 32 21