Classical photodissociation dynamics with Bohr quantization: Application to the fragmentation of a van der Waals cluster

被引：6

作者：

Arbelo-Gonzalez, W. ^{[1
,2
]}

Bonnet, L. ^{[1
]}

Larregaray, P. ^{[1
]}

Rayez, J. -C. ^{[1
]}

Rubayo-Soneira, J. ^{[2
]}

机构：

[1] Univ Bordeaux 1, Inst Mol Sci, F-33405 Talence, France

[2] Inst Super Tecnol & Ciencias Aplicadas, Dept Fis Gen, Havana 10600, Cuba

来源：

CHEMICAL PHYSICS | 2012年 / 399卷

关键词：

Photodissociation dynamics; Classical description; Standard forward approach; Gaussian binning; New backward approach; VIBRATIONAL PREDISSOCIATION; NEBR2; DISSOCIATION;

D O I：

10.1016/j.chemphys.2011.07.022

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

The recent classical dynamical approach of photodissociations with Bohr quantization [L. Bonnet, J. Chem. Phys. 133 (2010) 174108] is applied for the first time to a realistic process, the photofragmentation of the van der Waals cluster NeBr2. We illustrate the fact that this approach, formally equivalent to the standard one, may be numerically much more efficient. (C) 2011 Elsevier B.V. All rights reserved.

引用

页码：117 / 121

页数：5

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