Unexpected relations between matrix elements of the three-body scalar operators ti in the f shell |
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Authors: | M. Bentley B.R. Judd G.M.S. Lister |
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Affiliation: | Henry A. Rowland Department of Physics and Astronomy, The Johns Hopkins University, Baltimore, MD 21218, USA |
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Abstract: | It has been known for some time that crystal-field matrix elements (i.e., matrix elements of sums over spherical harmonics involving the coordinates of the individual electrons) are often unexpectedly proportional to one another in the f shell. To see whether similar relations hold for more complicated operators than those provided by the crystal field, we examined the matrix elements of the three-electron scalar operators ti for all configurations fN, as calculated by W. T. Carnall on the basis of the computer program of Hannah Crosswhite. These operators are widely used to take configuration interaction into account, and we found a surprising number of proportionalities that go beyond what would be expected on a straightforward application of the Wigner-Eckart theorem, as applied to the irreducible representations of the classic groups SO(7), G2 and SO(3) used by Racah in defining the f-electron states. A listing of such relations is provided. |
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