A GENERALIZED HYLLERAAS CORRELATIVE FACTOR IN VARIATIONAL CALCULATION

Authors
Citation
Cg. Bao et Jn. He, A GENERALIZED HYLLERAAS CORRELATIVE FACTOR IN VARIATIONAL CALCULATION, Journal of physics. B, Atomic molecular and optical physics, 28(11), 1995, pp. 2039-2047
Citations number
12
Categorie Soggetti
Physics, Atomic, Molecular & Chemical",Optics
ISSN journal
09534075
Volume
28
Issue
11
Year of publication
1995
Pages
2039 - 2047
Database
ISI
SICI code
0953-4075(1995)28:11<2039:AGHCFI>2.0.ZU;2-6
Abstract
A generalized Hylleraas type of correlative factor which includes the l not equal 0 partial waves of relative motion of each pair of particl es is introduced in variational calculations of few-body systems. As a n example, the ground state and the first doubly excited S-l(e) state of the helium atom are obtained simultaneously from a diagonalization of the Hamiltonian in an 11-dimensional model space spanned by basis f unctions with or without the generalized Hylleraas factor. It was foun d that this factor can in general improve the eigenenergies; in partic ular, it affects explicitly the structure of the wavefunction of the e xcited state.