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Hi there is Qinghan Yu's GitHub!👋

  • 🎓 I’m a student on Soochow University(PRC).
  • 🌱 I’m currently learning computational chemistry.
  • 💬 Ask me about Molecular Dynamics.
  • 📫 How to reach me: go to my personal homepage and find my email.
  • 😍 Interests: Bike, Computer, GPU, HPC, Tennis🎾, Badminton🏸, OST🎶, Wood product craftsmanship🪵 and so on.

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Qinghan Yu's Projects

kmc_lammps icon kmc_lammps

kMC is a custom fix for LAMMPS molecular dynamics that mimics the reaction kinetics of the Butler-Volmer equation

schnet icon schnet

SchNet - MLFF based on Tensorflow----selflearning

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