Benchmark comparison of dual-basis double-hybrid density functional theory and a neural-network-optimized method for intermolecular interactions
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Feb 01, 2021
- Source ID
- 10.1016/j.jms.2020.111406
Entities
People
- Jason N. Byrd
- Jesse J Lutz
- John A. Montgomery Jr.
Organizations
- Defense Threat Reduction Agency