Data-Driven Many-Body Potential Energy Functions for Generic Molecules: Linear Alkanes as a Proof-of-Concept Application

Document Details

Document Type
Pub Defense Publication
Publication Date
Sep 16, 2022
Source ID
10.1021/acs.jctc.2c00645

Entities

People

  • Ethan F. Bull-vulpe
  • Francesco Paesani
  • Marc Riera
  • Sigbjørn L. Bore

Organizations

  • Air Force Office of Scientific Research
  • National Science Foundation
  • University of California, San Diego