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@VeloxChem

VeloxChem

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  1. VeloxChem VeloxChem Public

    VeloxChem is a Python-based open source quantum chemistry software developed for computing molecular properties and a variety of spectroscopies from response theory.

    C++ 47 9

  2. vlxman vlxman Public

    Website documentation for the VeloxChem program.

    TeX 16 3

  3. vlx-notebook vlx-notebook Public

    This repository contains a collection of Jupyter Notebooks and input files used to demonstrate VeloxChem capabilities. Each folder correspond to a specific event (conference, article, school, ..)

    Jupyter Notebook 2

  4. vlx-twoe-ints vlx-twoe-ints Public

    Python 1

  5. meta-vlx meta-vlx Public

    Dockerfile 1

  6. Litmus Litmus Public

    Litmus is an automated molecular integrals generator

    C++

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