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  • add_time Public

    Forked from mandalgrouptamu/cavOTF

    Code for simulating vibrational polaritons on-the-fly

    Python Updated Feb 22, 2026

  • QED Public

    Python Updated Dec 18, 2025

  • Data-cavOTF Public

    Data used to produce figures for "On-the-Fly Cavity–Molecular Dynamics of Vibrational Polaritons"

    Python Updated Dec 15, 2025

  • qtic Public

    Quantum Tic-Tac-Toe

    HTML Updated Jun 20, 2025

  • MP2 Public

    A lightweight Python tool for calculating MP2 correlation energies and generating potential energy surface (PES) plots for molecular systems. Ideal for educational or prototyping purposes.

    Python MIT License Updated May 20, 2025

  • polar_preview Public

    Forked from zhcui/polar_preview

    Polariton and polaron (electron-boson coupled) systems from a quantum chemical perspective.

    Python GNU General Public License v3.0 Updated Dec 18, 2023

  • psi4numpy Public

    Forked from psi-rking/psi4numpy

    Combining Psi4 and Numpy for education and development.

    Jupyter Notebook BSD 3-Clause "New" or "Revised" License Updated Jan 18, 2018

  • juxif Public

    Forked from mahrud/juxif

    Jux Interface

    Python Updated Jun 2, 2013