PotentialEnergySurfaceofH2+HeSystem

被引：0

作者：

孙祉伟

王德民

邓坤杰

机构：

[1] Institute of Mechanics

[2] Academia Sinica

[3] Beijing

[4] PRC

[5] Department of Technical Physics

[6] Peking University

[7] The Central University of Nationalities

来源：

ProgressinNaturalScience | 1994年 / 04期

关键词：

H2+He system; potential energy surface; quantum Monte Carlo method;

D O I：

暂无

中图分类号：

O411.1 [数学物理方法];

学科分类号：

0701 ; 070104 ;

摘要：

<正> Using quantum Monte Carlo method, the potential surface of H2 + Hc system has been calculated. The result shows that two potential energy surfaces with the same symmetry can cross in a polyatom molecule. This result is important for polyatom molecular reaction theory.

引用

页码：69 / 72

页数：4