The binding of 4He and 3He to a hydrogen molecule:: A computational study for pH2 and oH2 -: art. no. 084308

被引：20

作者：

Gianturco, FA

González-Lezana, T

Delgado-Barrio, G

Villarreal, P

机构：

[1] Univ Roma La Sapienza, Dept Chem, I-00185 Rome, Italy

[2] Univ Roma La Sapienza, INFM, I-00185 Rome, Italy

[3] CSIC, Inst Matemat & Fis Fundamental, E-28006 Madrid, Spain

来源：

JOURNAL OF CHEMICAL PHYSICS | 2005年 / 122卷 / 08期

关键词：

D O I：

10.1063/1.1847511

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：

One bound state for the very weakly interacting complex of H-2 with one He atom is computed using a recently obtained, very accurate potential energy surface [A. I. Boothroyd and P. G. Martin, J. Chem. Phys. 119, 3187 (2003)] and employing a discrete variable representation expansion. The spatial features of this very diffused, "halo" state are analyzed and discussed for various isotopic variants of the title system. (C) 2005 American Institute of Physics.

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页数：5

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