skip to main content

DOE PAGESDOE PAGES

This content will become publicly available on January 22, 2019

Title: Calculations of non-adiabatic couplings within equation-of-motion coupled-cluster framework: Theory, implementation, and validation against multi-reference methods

Authors:
ORCiD logo [1] ;  [2] ; ORCiD logo [3]
  1. Department of Chemistry, University of Southern California, Los Angeles, California 90089, USA, Zernike Institute for Advanced Materials, Groningen, The Netherlands
  2. Department of Chemistry, Temple University, Philadelphia, Pennsylvania 19122, USA
  3. Department of Chemistry, University of Southern California, Los Angeles, California 90089, USA
Publication Date:
Grant/Contract Number:
FG02-05ER15685
Type:
Publisher's Accepted Manuscript
Journal Name:
Journal of Chemical Physics
Additional Journal Information:
Journal Volume: 148; Journal Issue: 4; Related Information: CHORUS Timestamp: 2018-02-15 00:35:52; Journal ID: ISSN 0021-9606
Publisher:
American Institute of Physics
Sponsoring Org:
USDOE
Country of Publication:
United States
Language:
English
OSTI Identifier:
1417718