Conditional Wave Function Theory: A Unified Treatment of Molecular Structure and Nonadiabatic Dynamics-Reference-Cited by-同舟云学术

Conditional Wave Function Theory: A Unified Treatment of Molecular Structure and Nonadiabatic Dynamics

Published:2021-11-09 Issue:12 Volume:17 Page:7321-7340
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Albareda Guillermo¹²³^ORCID,Lively Kevin³⁴^ORCID,Sato Shunsuke A.³⁵,Kelly Aaron³⁴⁶,Rubio Angel¹³⁴⁷^ORCID

Affiliation:

1. Nano-Bio Spectroscopy Group and European Theoretical Spectroscopy Facility (ETSF), Universidad del País Vasco (UPV/EHU), Av. Tolosa 72, 20018 San Sebastian, Spain

2. Institute of Theoretical and Computational Chemistry, University of Barcelona, Martí i Franquès 1-11, 08028 Barcelona, Spain

3. Max Planck Institute for the Structure and Dynamics of Matter and Center for Free-Electron Laser Science, Luruper Chaussee 149, 22761 Hamburg, Germany

4. The Hamburg Centre for Ultrafast Imaging, University of Hamburg, Luruper Chaussee 149, 22761 Hamburg, Germany

5. Center for Computational Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8577, Japan

6. Department of Chemistry, Dalhousie University, Halifax, Nova Scotia B3H 4R2, Canada

7. Center for Computational Quantum Physics (CCQ), Flatiron Institute, 162 Fifth Avenue, New York, New York 10010, United States

Funder

Ministerio de Ciencia e Innovaci??n

Ministerio de Econom??a y Competitividad

Deutsche Forschungsgemeinschaft

Ag??ncia de Gesti?? d???Ajuts Universitaris i de Recerca

Secretar??a de Estado de Investigaci??n, Desarrollo e Innovaci??n

Japan Society for the Promotion of Science

Universit??t Hamburg