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uday-sankar/README.md
  • 👋 Hi, I’m Uday Sankar
  • A Chemsitry PhD student at the Muechler Lab Penn State.
  • Trying to solve chemical mysteries with the help of computers.
  • Find something interesting? reach out to me LinkedIn: linkedin.com/in/udaysankarmanoj

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  1. Jacobi_to_Cartesian Jacobi_to_Cartesian Public

    A simple Julia script to covert Jacobi coordinates to Cartesian coordinates

    Julia

  2. MD-Simulation-using-Julia MD-Simulation-using-Julia Public

    A 3D Molecular dynamics simulation code in Julia. Velocity vert based time integration nd geometry stabilizations implemented.

    Julia

  3. Mol_Viz Mol_Viz Public

    A python matplotlib based molecular visualization tool.

    Jupyter Notebook

  4. Numerical-Solution-to-Schrodinger-Eqs Numerical-Solution-to-Schrodinger-Eqs Public

    A small journey into the quatum realm with python

    Python

  5. Numerov_Ammonia_inversion Numerov_Ammonia_inversion Public

    V=K*(C_4*(x**4)+C_2*(x**2)+C_0)

    Jupyter Notebook

  6. QuantumWavePacket QuantumWavePacket Public

    Simple wave packet simulations for one dimensional system

    Julia