Minimal Experimental Bias on the Hydrogen Bond Greatly Improves Ab Initio Molecular Dynamics Simulations of Water
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Jul 28, 2020
- Source ID
- 10.1021/acs.jctc.0c00558
Entities
People
- Glen M Hocky
- Gregory A. Voth
- Paul B. Calio
Organizations
- National Institute of General Medical Sciences
- New York University
- Office of Basic Energy Sciences
- Office of Naval Research Global
- University of Chicago