skip to main content

Title: Accurate and efficient DFT-based diabatization for hole and electron transfer using absolutely localized molecular orbitals
Authors:
 ;  ;  
Award ID(s):
1652960
Publication Date:
NSF-PAR ID:
10122148
Journal Name:
The Journal of Chemical Physics
Volume:
151
Issue:
16
Page Range or eLocation-ID:
Article No. 164114
ISSN:
0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
National Science Foundation
More Like this
No document suggestions found