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Achievement: Pull Sharkx2Achievement: Arctic Code Vault Contributor
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@comocheng
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  1. comocheng/bm_project comocheng/bm_project Public

    Scripts for BMA paper

    Jupyter Notebook 1

  2. Cantera/cantera Cantera/cantera Public

    Chemical kinetics, thermodynamics, and transport tool suite

    C++ 580 341

  3. comocheng/ChemCheck comocheng/ChemCheck Public

    PyCanChemAndYouCan2! A tool to check chemistry, in the form of chemkin and cantera files.

    Python 12 4

  4. ReactionMechanismGenerator/RMG-Py ReactionMechanismGenerator/RMG-Py Public

    Python version of the amazing Reaction Mechanism Generator (RMG).

    Python 374 227

  5. comocheng/QE-scripts comocheng/QE-scripts Public

    This repository has the scripts to run Quantum Espresso (QE) for structure optimization and transition sate search with nudged elastic band(NEB), nudged elastic band climing image (NEB-CI) algorithm.

    Python