Perturbation theory for the hydrogen atom in a spherical cavity with off-centre nucleus

被引:39
|
作者
Changa, ME [1 ]
Scherbinin, AV [1 ]
Pupyshev, VI [1 ]
机构
[1] Moscow MV Lomonosov State Univ, Dept Chem, Lab Mol Struct & Quantum Mech, Moscow 119899, Russia
关键词
D O I
10.1088/0953-4075/33/3/311
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The problem of a hydrogen atom in an impenetrable spherical cavity of small radius R is considered on the basis of the first-order perturbational treatment of the electron-nucleus interaction taking explicit account of the boundary condition. An approximate analytic expression is derived for the electronic energy as a function of the shift of the nucleus off the centre. The estimations obtained are in good qualitative and semiquantitative agreement with the results of the finite-difference calculations. Some general features of the energy dependences are discussed qualitatively.
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页码:421 / 432
页数:12
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