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Popular repositories

  1. psi4numpy psi4numpy Public

    Forked from psi4/psi4numpy

    Combining Psi4 and Numpy for education and development.

    Jupyter Notebook

  2. psi4 psi4 Public

    Forked from psi4/psi4

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

    C++

  3. wrap_pyscf wrap_pyscf Public

    Python 2

  4. PluginPlayer PluginPlayer Public

    Forked from NWChemEx/PluginPlayer

    GUI for PluginPlay

    Python

  5. FriendZone FriendZone Public

    Forked from NWChemEx/FriendZone

    Provides SimDE compatible APIs to existing packages

    Python

  6. QCEngine QCEngine Public

    Forked from MolSSI/QCEngine

    Quantum chemistry program executor and IO standardizer (QCSchema).

    Python