PROPERTIES OF SINGLE-TERM ATOMIC STATES CALCULATED IN A VARIATIONALLY OPTIMIZED-LOCAL-CENTRAL-POTENTIAL MODEL

被引：57
作者：
AASHAMAR, K
LUKE, TM
TALMAN, JD
机构：
[1] UNIV WESTERN ONTARIO,CTR CHEM PHYS,LONDON N6A 3K7,ONTARIO,CANADA
[2] UNIV WESTERN ONTARIO,DEPT APPL MATH,LONDON N6A 5B9,ONTARIO,CANADA
[3] UNIV WESTERN ONTARIO,DEPT PHYS,LONDON N6A 5B9,ONTARIO,CANADA
[4] UNIV WESTERN ONTARIO,CTR CHEM PHYS,LONDON N6A 5B9,ONTARIO,CANADA
来源：
PHYSICAL REVIEW A | 1979年 / 19卷 / 01期
关键词：
D O I：
10.1103/PhysRevA.19.6
中图分类号：
O43 [光学];
学科分类号：
070207 ; 0803 ;
摘要：
A method has been developed for calculating properties of single-term atomic states using a variationally optimized effective local central potential. The method has been applied to the ground states and, in certain cases, low-lying excited states of the elements with 3Z54. Results are presented for the energies of these states and certain other properties such as dipole polarizabilities and single-particle orbital parameters. The results show that the method leads to wave functions that are very close to Hartree-Fock wave functions but for which the single-particle orbitals can be obtained from a single numerical central potential. © 1979 The American Physical Society.
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页码：6 / 16
页数：11
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