Browse Abstracts & Presentations - 2021 International Symposium on Molecular Spectroscopy by Contributor "Finney, Jacob M"

  • Diffusion Monte Carlo Using Machine Learning Potential Energy Surfaces 
    DiRisio, Ryan J. (International Symposium on Molecular Spectroscopy, 2021-06-23)
    Diffusion Monte Carlo (DMC) is a technique for obtaining the ground-state solution to the vibrational time-independent Schrödinger equation based on a stochastic sampling of an electronic potential energy surface (PES). ...

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