@inproceedings{ca3118503acf46c583f089f4905ad0e5,
title = "Semiclassical instanton theory of nonadiabatic reaction rate constant. I. Formulation",
abstract = "The reaction rate constant of electronically nonadiabatic chemical reactions is formulated by extending the semiclassical instanton theory of adiabatic chemical reaction with use of the Zhu-Nakamura theory of nonadiabatic transition. The instanton trajectory at a given temperature can be searched efficiently by the method used for multi-dimensional tunneling splitting. A compact expression of the rate constant applicable to multi-dimensional systems is derived.",
keywords = "instanton, nonadiabatic transition, reaction rate, semiclassical theory",
author = "Yoshiaki Teranishi and Hiroki Nakamura and Lin, {Sheng H.}",
note = "Publisher Copyright: {\textcopyright} 2012 American Institute of Physics.; International Congress in Theory and Applications in Computational Chemistry: The First Decade of the Second Millennium, TACC 2012 ; Conference date: 02-09-2012 Through 07-09-2012",
year = "2012",
doi = "10.1063/1.4730651",
language = "English",
series = "AIP Conference Proceedings",
publisher = "American Institute of Physics Inc.",
pages = "119--130",
editor = "Jean-Marie Andre and Enrico Clementi and McCammon, {J. Andrew}",
booktitle = "Theory and Applications in Computational Chemistry",
address = "美國",
}