B-spline basis implementation of the Hartree-Fock method for arbitrary central potentials

被引:0
作者
Waide, D. T. [1 ]
Green, D. G. [1 ]
Gribakin, G. F. [1 ]
机构
[1] Queens Univ Belfast, Sch Math & Phys, Belfast BT7 1NN, Antrim, North Ireland
来源
31ST INTERNATIONAL CONFERENCE ON PHOTONIC, ELECTRONIC AND ATOMIC COLLISIONS (ICPEAC XXXI) | 2020年 / 1412卷
关键词
D O I
10.1088/1742-6596/1412/13/132029
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The Hartree-Yock equations are solved using B-splines. Convergence of self-consistency iterations is achieved by turning on the electron interaction gradually. We test the ground and excited-state sets for atoms and an electron gas confined in a harmonic potential and the jellium model of alkali-metal clusters. Comparisons are made with the Thomas-Fermi approximation arid dipole polarizabilities are found and compared with experiment.
引用
收藏
页数:1
相关论文
共 6 条
[1]  
Amusia M. Ya., 1997, COMPUTATION ATOMIC P, DOI [10.1887/0750302291, DOI 10.1887/0750302291]
[2]   A B-spline Hartree-Fock program [J].
Fischer, Charlotte Froese .
COMPUTER PHYSICS COMMUNICATIONS, 2011, 182 (06) :1315-1326
[3]   Positron scattering and annihilation on noble-gas atoms [J].
Green, D. G. ;
Ludlow, J. A. ;
Gribakin, G. F. .
PHYSICAL REVIEW A, 2014, 90 (03)
[4]   DIPOLE EXCITATIONS OF CLOSED-SHELL ALKALI-METAL CLUSTERS [J].
GUET, C ;
JOHNSON, WR .
PHYSICAL REVIEW B, 1992, 45 (19) :11283-11287
[5]   ELECTRONIC SHELL STRUCTURE IN POTASSIUM CLUSTERS [J].
KNIGHT, WD ;
DEHEER, WA ;
CLEMENGER, K ;
SAUNDERS, WA .
SOLID STATE COMMUNICATIONS, 1985, 53 (05) :445-446
[6]   A measurement of the polarizability of sodium clusters [J].
Tikhonov, G ;
Kasperovich, V ;
Wong, K ;
Kresin, VV .
PHYSICAL REVIEW A, 2001, 64 (06) :5