Nonadiabatic dynamics: The SHARC approach

Mai, S; Marquetand, P; Gonzalez, L

Gonzalez, L (reprint author), Univ Vienna, Inst Theoret Chem, Fac Chem, Wahringer Str 17, A-1090 Vienna, Austria.

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE, 2018; 8 (6):

Abstract

We review the Surface Hopping including ARbitrary Couplings (SHARC) approach for excited-state nonadiabatic dynamics simulations. As a generalization ......

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