A GENERAL PROGRAM FOR COMPUTING ANGULAR INTEGRALS OF THE BREIT-PAULI HAMILTONIAN

被引：132

作者：

HIBBERT, A ^{[1
]}

GLASS, R ^{[1
]}

FISCHER, CF ^{[1
]}

机构：

[1] VANDERBILT UNIV,DEPT COMP SCI,NASHVILLE,TN 37235

来源：

COMPUTER PHYSICS COMMUNICATIONS | 1991年 / 64卷 / 03期

关键词：

ATOMIC STRUCTURE; CONFIGURATION INTERACTION; RELATIVISTIC SHIFT; SPIN-ORBIT INTERACTION; FINE-STRUCTURE SPLITTING; COMPLEX ATOMS; WAVE FUNCTIONS; BOUND STATES; LSJ COUPLING;

D O I：

10.1016/0010-4655(91)90138-B

中图分类号：

TP39 [计算机的应用];

学科分类号：

081203 ; 0835 ;

摘要：

The MCHF}BREIT program performs the angular integrations necessary for expressing the matrix elements of the Breit-Pauli Hamiltonian (except for the orbit-orbit operator) as linear combinations of radial integrals. All matrix elements for a given list of configuration states may be evaluated or selected subsets. An orthonormal set of orbitals is assumed.

引用

页码：455 / 472

页数：18

共 16 条

[1] THEORY OF SPIN-ORBIT COUPLING IN ATOMS .1. DERIVATION OF SPIN-ORBIT COUPLING CONSTANT [J].