Classical photodissociation dynamics with Bohr quantization

被引：6

作者：

Bonnet, L. ^{[1
]}

机构：

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

来源：

JOURNAL OF CHEMICAL PHYSICS | 2010年 / 133卷 / 17期

关键词：

TRAJECTORY METHOD; COMPLEX;

D O I：

10.1063/1.3502492

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 standard classical expression of the state-resolved photodissociation cross section is not consistent with an efficient Bohr quantization of product internal motions. A new and strictly equivalent expression not suffering from this drawback is proposed. This expression opens the way to more realistic classical simulations of direct polyatomic photodissociations in the quantum regime where only a few states are available to the products. (C) 2010 American Institute of Physics. [doi: 10.1063/1.3502492]

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页数：5

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