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Автор P H M Uylings
Дата выпуска 1984-06-28
dc.description The l<sup>N</sup> configuration is described as a collection of <sup>1</sup>/<sub>2</sub>N(N-1) electron pairs, with the angular momenta of the electrons of each pair being coupled to the (2l+1) SL terms of l<sup>2</sup>. In this way, a set of parameters is defined which can be visualised as the energies of these particular SL terms. The parameters represent the effects of two-particle excitations on the l<sup>N</sup> configuration to second order. Moreover, they turn out, after a minor modification, to form an orthogonal set. The number of pairs multiplied by the average pair energy proves to be equal to the average energy of the full l<sup>N</sup> configuration. Inner products of general two-particle operators are calculated and conditions for their orthogonality are derived. For the d<sup>N</sup> configurations, two orthogonal three-body operators are added in order to obtain a complete set of electrostatic parameters. A simple general procedure is sketched that allows for the determination of the contributions of physical excitations to the various orthogonal parameters. This is illustrated by the s to d case. Values of all the matrix elements used are given.
Формат application.pdf
Издатель Institute of Physics Publishing
Название Energies of N equivalent electrons expressed in terms of two-electron energies and independent three-electron parameters: a new complete set of orthogonal operators. I. Theory
Тип paper
DOI 10.1088/0022-3700/17/12/009
Print ISSN 0022-3700
Журнал Journal of Physics B: Atomic and Molecular Physics
Том 17
Первая страница 2375
Последняя страница 2392
Аффилиация P H M Uylings; Zeeman-Lab., Univ. van Amsterdam, Amsterdam, Netherlands
Выпуск 12

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