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  • Grande Prairie, Alberta

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Pinned

  1. gbasis gbasis Public

    Forked from theochem/gbasis

    Python library for Gaussian basis function evaluation & integrals

    Python

  2. QuixoticSimulating QuixoticSimulating Public

    Simulation code for rigid polyatomic mixtures written in Julia. Uses bare coulomb, Wolf or Ewald summation for electrostatics.

    Julia

  3. iodata iodata Public

    Forked from FarnazH/iodata

    Python