Non-adiabatic dynamics close to conical intersections and the surface hopping perspective

Conical intersections play a major role in the current understanding of electronic de-excitation in polyatomic molecules, and thus in the description of photochemistry and photo physics of molecular systems. This article reviews aspects of the basic theory underlying the description of non-adiabatic...

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Bibliographic Details
Main Authors: João Pedro eMalhado, Michael John Bearpark, James T Hynes
Format: Article
Language:English
Published: Frontiers Media S.A. 2014-11-01
Series:Frontiers in Chemistry
Subjects:
Online Access:http://journal.frontiersin.org/Journal/10.3389/fchem.2014.00097/full