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Generalized Ab Initio Nonadiabatic Dynamics Simulation Methods from Molecular to Extended Systems.

Authors :
Bin-Bin Xie
Pei-Ke Jia
Ke-Xin Wang
Wen-Kai Chen
Xiang-Yang Liu
Ganglong Cui
Source :
Journal of Physical Chemistry A; 3/24/2022, Vol. 126 Issue 11, p1789-1804, 16p
Publication Year :
2022

Details

Language :
English
ISSN :
10895639
Volume :
126
Issue :
11
Database :
Supplemental Index
Journal :
Journal of Physical Chemistry A
Publication Type :
Academic Journal
Accession number :
156403817
Full Text :
https://doi.org/10.1021/acs.jpca.1c10195