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  • McMaster University
  • Hamilton, ON, Canada

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  1. pyeom pyeom Public

    Python 2

  2. AtomDB AtomDB Public

    Forked from theochem/AtomDB

    An Extended Periodic Table of Neutral and Charged Atomic Species

    Python

  3. ModelHamiltonian ModelHamiltonian Public

    Forked from theochem/ModelHamiltonian

    Generate 1- and 2-electron integrals so that molecular quantum chemistry software can be used for model Hamiltonians.

    HTML

  4. theochem/PyCI theochem/PyCI Public

    A flexible ab-initio quantum chemistry library for (parameterized) configuration interaction calculations.

    C++ 18 11