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Focusing
🎯
Focusing
11 followers · 26 following

Achievements

Achievement: Pull SharkAchievement: Pair ExtraordinaireAchievement: YOLO

Achievements

Achievement: Pull SharkAchievement: Pair ExtraordinaireAchievement: YOLO

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  1. QHformer QHformer Public

    SO(3)-Equivariant Hamiltonian Prediction with Hybrid Attention - A novel neural network for quantum chemistry

    Python

  2. GradTDDFT GradTDDFT Public

    JAX research toolkit for differentiable TDDFT: strict-JAX SCF, TDA/Casida TDDFT, Neural Network XC/RSH training, spectra, integrals, and CUDA J/K experiments.

    Python 1

  3. OPTXC OPTXC Public

    This is a project for optimization of Exchange-Correlation Functionals in LR-TDDFT calculations.

    Jupyter Notebook

  4. Talk Talk Public

    Academic talk archive during my Ph.D. This repository keeps PDF versions of group-meeting slides, proposal materials, and research updates