Adjustment of the quasirelativistic equations for p electrons

P. Bogdanovich and O. Rancova
Phys. Rev. A 76, 012507 – Published 18 July 2007

Abstract

A development of the techniques for solving the quasirelativistic Hartree-Fock equations for quasirelativistic atomic calculations published earlier [Phys. Rev. A 74, 052501 (2006)] is presented. Trial calculations using these techniques revealed that the one-electron characteristics and spin-orbit splitting are less precise in the case of p electrons. To overcome this problem, a different method of averaging the spin-orbit interaction within the quasirelativistic Hartree-Fock equation is proposed for p electrons. The specific account of the contact interaction in the case of p electrons is discussed. The technique for calculating the spin-orbit interaction constant while using the quasirelativistic radial orbitals is presented. Since the pecularities appear on the level of one-electron interactions, only hydrogenlike ions are investigated. Data revealing how the methods under discussion influence the results obtained are presented.

  • Received 18 May 2007

DOI:https://doi.org/10.1103/PhysRevA.76.012507

©2007 American Physical Society

Authors & Affiliations

P. Bogdanovich* and O. Rancova

  • Institute of Theoretical Physics and Astronomy of Vilnius University, A. Goštauto 12, LT-01108 Vilnius, Lithuania

  • *pavlas@itpa.lt

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Issue

Vol. 76, Iss. 1 — July 2007

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