Molecule-Optimized Basis Sets and Hamiltonians for Accelerated Electronic Structure Calculations of Atoms and Molecules
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jan 06, 2014
- Source ID
- 10.1021/jp410191y
Entities
People
- David A Mazziotti
- Gergely Gidofalvi
Organizations
- Army Research Office
- Gonzaga University
- National Science Foundation
- University of Chicago