A Generalized Surface Hopping Algorithm To Model Nonadiabatic Dynamics near Metal Surfaces: The Case of Multiple Electronic Orbitals
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- May 18, 2017
- Source ID
- 10.1021/acs.jctc.7b00094
Entities
People
- Joseph E Subotnik
- Wenjie Dou
Organizations
- Air Force Office of Scientific Research
- David and Lucile Packard Foundation
- The Camille and Henry Dreyfus Foundation
- University of Pennsylvania