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Chemistry on Computers
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Chemistry on Computers

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@CrawfordGroup

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  1. CrawfordGroup/MLQM CrawfordGroup/MLQM Public

    Machine-learning quantum mechanics

    Python 10 4

  2. mesp mesp Public

    My Electronic Structure Package

    Python 3 2

  3. CrawfordGroup/lml CrawfordGroup/lml Public

    Learning Machine Learning

    Jupyter Notebook 15 11

  4. HF_Int HF_Int Public

    Homemade Hartree Fock code with fresh-baked integrals, coded right here in Python

    Python 2 1

  5. xyz_tables xyz_tables Public

    A python script for converting .xyz tables to LaTeX tables.

    Python 1 2

  6. reg_ind reg_ind Public

    Takes text and converts it to `:regional_indicator_X:` form, for use as emojis in Discord text chat.

    Python 1