Isotope effects in molecular structures and electronic properties of liquid water via deep potential molecular dynamics based on the SCAN functional
Document Details
- Document Type
- Pub Defense Publication
- Publication Date
- Dec 21, 2020
- Source ID
- 10.1103/physrevb.102.214113
Entities
People
- Biswajit Santra
- Chunyi Zhang
- Jianhang Xu
- Linfeng Zhang
- Mohan Chen
- Xifan Wu
Organizations
- National Science Foundation
- Office of Basic Energy Sciences
- United States Army Research Laboratory
- United States Department of Energy