Regression Clustering for Improved Accuracy and Training Costs with Molecular-Orbital-Based Machine Learning

Document Details

Document Type
Pub Defense Publication
Publication Date
Oct 22, 2019
Source ID
10.1021/acs.jctc.9b00884

Entities

People

  • Lixue Cheng
  • Matthew Welborn
  • Nikola B. Kovachki
  • Thomas Miller

Organizations

  • Air Force Office of Scientific Research
  • Army Research Office
  • California Institute of Technology
  • National Science Foundation
  • Office of Naval Research
  • Resnick Sustainability Institute for Science, Energy and Sustainability, California Institute of Technology

Tags

Technology Areas

  • AI & ML
  • AI & ML - Neural Networks
  • Space