APS Logo

Highly accuracte wavefunction calculations with deep Quantum Monte Carlo

ORAL

Abstract

Deep learning has had profound impact on the computational sciences in several key areas and can manifest itself by higher speed or higher accuracy compared to traditional simulations or calculations. Here I will discuss the highly accurate solutions of molecular systems with neural wavefunctions and describe recent developments of architectures, training methods and other technical improvements.

Presenters

  • Frank Noe

    Microsoft Corporation

Authors

  • Frank Noe

    Microsoft Corporation