Nonadiabatic dynamics study of methaniminium with ORMAS:...

Computational and Theoretical Chemistry 2014 / 07 Vol. 1040-1041

Nonadiabatic dynamics study of methaniminium with ORMAS: Challenges of incomplete active spaces in dynamics simulations

West, Aaron C., Barbatti, Mario, Lischka, Hans, Windus, Theresa L.
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Volume:
1040-1041
Language:
english
Journal:
Computational and Theoretical Chemistry
DOI:
10.1016/j.comptc.2014.03.015
Date:
July, 2014
File:
PDF, 1.61 MB
english, 2014
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