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Achievement: Pull Shark
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Pinned

  1. sokolov-group/prism sokolov-group/prism Public

    Python-based implementation of electronic structure theories for simulating spectroscopic properties

    Python 8 1

  2. sokolov-group/sqa_plus sokolov-group/sqa_plus Public

    Enhanced implementation of Second Quantization Algebra

    Python 4 1

  3. isGAMESS isGAMESS Public

    A script to automate calculation of inner-shell electronic excited states using IS-MCSCF method in GAMESS

    Python 1

  4. getThermo getThermo Public

    A tool to obtain thermodynamic properties of chemical systems selecting normal modes which describes vibrational movement

    Fortran 2 1

  5. CompChemTools CompChemTools Public

    Personal scripts to simplify computational chemistry activities

    Mathematica 2 1

  6. blog-posts blog-posts Public

    Auxiliary files for my blog posts in carlosevmoura.org

    Jupyter Notebook 1