skip to main content

DOE PAGESDOE PAGES

This content will become publicly available on May 16, 2017

Title: The DQ and DQΦ electronic structure diabatization methods: Validation for general applications

Authors:
 [1] ;  [1] ;  [1] ;  [1]
  1. Department of Chemistry, Chemical Theory Center, and Minnesota Supercomputing Institute, University of Minnesota, 207 Pleasant St. SE, Minneapolis, Minnesota 55455-0431, USA
Publication Date:
OSTI Identifier:
1253223
Grant/Contract Number:
SC0008666
Type:
Publisher's Accepted Manuscript
Journal Name:
The Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 144; Journal Issue: 19; Related Information: CHORUS Timestamp: 2016-05-16 13:12:02; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English