Active Space Dependence in Multiconfiguration Pair-Density Functional Theory
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Feb 01, 2018
- Source ID
- 10.1021/acs.jctc.7b01052
Entities
People
- Donald Truhlar
- Laura Gagliardi
- Prachi Sharma
Organizations
- Air Force Office of Scientific Research
- University of Minnesota Supercomputing Institute