Reference potential approach to the energy eigenvalue problem of a rotating diatomic molecule

2008 ◽  
Vol 462 (4-6) ◽  
pp. 337-343 ◽  
Author(s):  
Matti Selg ◽  
Vladislav Belous

It is shown that the dipole moment function, μ ( R , Z a , Z b ), for an arbitrary bound electronic state of a one-electron diatomic molecule, with inter-nuclear distance R and atomic numbers Z a , Z b may be expressed exactly in terms of the separation eigenconstant C and the electronic energy eigenvalue W of the Schrödinger equation by means of the Hellmann-Feynman theorem and a new recursion relation. The formula is used to investigate the behaviour of μ in the vicinity of the united atom and when the nuclei are far apart. The generalization required to extend the relation to other expectation values is derived in an appendix.


1971 ◽  
Vol 4 (5) ◽  
pp. 2110-2110
Author(s):  
Hsiao S. Kiang

1983 ◽  
Vol 4 (2) ◽  
pp. 218-225 ◽  
Author(s):  
Hafez Kobeissi ◽  
Mounzer Dagher ◽  
Mahmoud Korek ◽  
Ahmad Chaalan

2005 ◽  
Vol 70 (7) ◽  
pp. 864-880 ◽  
Author(s):  
Jacek Karwowski ◽  
Lech Cyrnek

An algebraic approach to solving a class of one-particle Schrödinger equations is presented. As an example, quasi-exact solutions of the eigenvalue problem of a Hamiltonian describing two interacting particles confined in a parabolic well are obtained. This example constitutes a unification and a generalization of several models known in the literature, as the ones of Taut (Phys. Rev. A 1993, 48, 3561) and of Samanta and Ghosh (Phys. Rev. A 1990, 42, 1178). Two confined particles interacting by Coulomb forces and the nuclear motion of a diatomic molecule are discussed as practical implementations.


1970 ◽  
Vol 2 (3) ◽  
pp. 806-810 ◽  
Author(s):  
Hsiao S. Kiang

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