Phys. Rev. A 25, 1513 - 1527 (1982)

Correlation of two particles on a sphere

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Gregory S. Ezra and R. Stephen Berry
Department of Chemistry and The James Franck Institute, The University of Chicago, Chicago, Illinois 60637

Received 18 September 1981

We consider the correlation of two particles on a sphere interacting via various repulsive forces: a Coulomb repulsion, a Gaussian, and a δ function. This "rigid-bender" picture with Coulomb repulsion provides a schematic model of intrashell angular correlation in doubly excited two-electron atoms. We examine energy levels and reduced densities ρ(θ12) for states corresponding to shells n1=n2=2,3,4. Energy levels for fully converged states fall into remarkable rovibrator patterns, as found in the corresponding three-dimensional case by Kellman and Herrick. The rovibrator nature of the states is directly reflected in plots of ρ(θ12), which reveal both collective rotations and vibrations and even the influence of centrifugal distortion. A minimal basis (lmax=n-1) is inadequate to represent angular correlation in the higher-energy states of each shell. The repulsive Gaussian potential, which is finite at θ12=0, shows the onset of independent-particle shell-model behavior in higher-energy states. Comparison of the Coulomb case with the delta-function potential exhibits the degree to which kinematics governs wave-function character.


©1982 The American Physical Society

URL: http://link.aps.org/abstract/PRA/v25/p1513
DOI: 10.1103/PhysRevA.25.1513

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