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lhycms/README.md

Hi there, I'm Hanyu Liu (刘晗煜)

  • 👨‍💻 I’m currently working on Monte Carlo algorithm (MC), Machine Learning potential (MLIP), Density Functional Theory (DFT), Molecular Dynamics (MD), etc.

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  1. AI2Pot AI2Pot Public

    Ab Initio and Artificial Intelligence POTential framework

    C++ 5

  2. AI2Pot-cli AI2Pot-cli Public

    Command-line interface for AI2Pot

    Python 3