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  1. Gaussian-Tools Gaussian-Tools Public

    quantum-related codes for extracting matrices and using them

    Python 1 1

  2. AATGaussPackage AATGaussPackage Public

    Gaussian utility Package

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  3. CodingHomework-Example CodingHomework-Example Public

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    This is the coding homework repo test.

  4. ProgrammingExercises-hphratchian ProgrammingExercises-hphratchian Public

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  5. scfEnergyTerms scfEnergyTerms Public

    Forked from hphratchian/scfEnergyTerms

    This code pulls some key terms and arrays from a Gaussian matrix file and uses them to compute a number of key SCF energy terms.

    Fortran