Third-order many-body perturbation theory calculations for the beryllium and magnesium isoelectronic sequences

被引:15
作者
Ho, H. C.
Johnson, W. R.
Blundell, S. A.
Safronova, M. S.
机构
[1] Univ Notre Dame, Dept Phys, Notre Dame, IN 46556 USA
[2] CEA Grenoble, Dept Rech Fondamentale Mat Condensee, DSM, F-38054 Grenoble 9, France
[3] Univ Delaware, Dept Phys, Newark, DE 19716 USA
来源
PHYSICAL REVIEW A | 2006年 / 74卷 / 02期
关键词
CONFIGURATION-INTERACTION CALCULATION; OSCILLATOR-STRENGTHS; ELECTRON ATOMS; ENERGY-LEVELS; TRANSITION; STATES; IONS;
D O I
10.1103/PhysRevA.74.022510
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
Third-order relativistic many-body perturbation theory (MBPT) is applied to obtain energies of ions with two valence electrons in the no virtual-pair approximation (NVPA). A total of 302 third-order Goldstone diagrams are organized into 12 one-body and 23 two-body terms. Only third-order two-body terms and diagrams are presented in this paper, owing to the fact that the one-body terms are identical to the previously studied third-order terms in monovalent ions. Dominant classes of diagrams are identified. The model potential is the Dirac-Hartree-Fock potential VN-2, and B-spline basis functions in a cavity of finite radius are employed in the numerical calculations. The Breit interaction is taken into account through the second order of perturbation theory, and the lowest-order Lamb shift is also evaluated. Sample calculations are performed for berylliumlike ions with Z=4-7, and for the magnesiumlike ion P IV. The third-order excitation energies are in excellent agreement with measurement with an accuracy at 0.2% level for the cases considered. Comparisons are made with second-order MBPT results, and with other calculations. The third-order energy correction is shown to be significant, improving the previous second-order calculations by an order of magnitude.
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页数:9
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