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Sutirthachowdhury/README.md
  • 👋 Hi, I’m @Sutirthachowdhury, theoretical and computational chemist.
  • 👀 I’m interested in Quantum dynamics | Molecular designing | Quantum Computing and Quantum information of Science.
  • 🌱 I’m currently learning c++ | QISKIT
  • 🌱 I'm currelty working various Quantum Chemistry Problems such as Electron and proton transfer mechanisms in complex reactions, CISS effects, IR-perturbed electron transfer, cavity-QED etc.
  • Proficient in coding (python, Fortran) | mathematical modelling | Quantum dynamics method development | data analysis | Quantum chemistry softwares.
  • 📫 How to reach me: sutirtha.chowdhury@duke.edu

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  1. SemiClassical-NAMD SemiClassical-NAMD Public

    Forked from mandalgrouptamu/SemiClassical-NAMD

    Semiclassical code for quantum dynamics

    Python 2

  2. Marcus_theory Marcus_theory Public

    Python 1

  3. Adiabatic_RPMD_method Adiabatic_RPMD_method Public

    This is a path-integral based quantum dynamics method, known as Ring Polymer Molecular Dynamics (RPMD). This method can captures quantum effects and successfully describe the ground state Chemical …

    Python 2

  4. DBA_cavity_polariton_Chemistry DBA_cavity_polariton_Chemistry Public

    Cavity induced electron transport for Biological macromolecules

    Python 5 1

  5. Nonadia_Matsubara_Dynamics Nonadia_Matsubara_Dynamics Public

    https://aip.scitation.org/doi/abs/10.1063/5.0042136?journalCode=jcp

    Fortran 1

  6. Fermi-s_golden_rule_cavity-ET Fermi-s_golden_rule_cavity-ET Public

    FGR (Jortner) theory for a cavity-assisted charge transfer process in a hybrid light-matter system.

    Fortran 1