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Achievement: QuickdrawAchievement: Starstruckx2Achievement: Pull Sharkx4Achievement: Pair Extraordinairex3Achievement: YOLOAchievement: Arctic Code Vault Contributor
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Achievements

Achievement: QuickdrawAchievement: Starstruckx2Achievement: Pull Sharkx4Achievement: Pair Extraordinairex3Achievement: YOLOAchievement: Arctic Code Vault Contributor
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@psi4
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Pinned

  1. psi4/psi4 psi4/psi4 Public

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

    C++ 927 432

  2. qcdb qcdb Public

    Databases and Interoperability in Quantum Chemistry

    Python 13 6

  3. pylibefp pylibefp Public

    python wrapper to I. Kaliman's libefp for effective fragment potentials

    Python 2

  4. MolSSI/QCElemental MolSSI/QCElemental Public

    Periodic table, physical constants, and molecule parsing for quantum chemistry.

    Python 132 68