Data-Efficient Machine Learning Potentials from Transfer Learning of Periodic Correlated Electronic Structure Methods: Liquid Water at AFQMC, CCSD, and CCSD(T) Accuracy

Document Details

Document Type
Pub Defense Publication
Publication Date
Feb 02, 2023
Source ID
10.1021/acs.jctc.2c01203

Entities

People

  • David R. Reichman
  • Hongzhou Ye
  • Joonho Lee
  • Michael S. Chen
  • Thomas E. Markland
  • Timothy Berkelbach

Organizations

  • Air Force Office of Scientific Research
  • Columbia University
  • Division of Chemistry
  • Flatiron Institute
  • Stanford University

Tags

Technology Areas

  • AI & ML
  • AI & ML - Neural Networks
  • Microelectronics