Maple procedures for the coupling of angular momenta. VIII. Spin-angular coefficients for single-shell configurations

Published: 1 March 2005| Version 1 | DOI: 10.17632/cpgbp7kj4c.1
G. Gaigalas, O. Scharf, S. Fritzsche


Abstract Matrix elements of physical operators are required when the accurate theoretical determination of atomic energy levels, orbitals and radiative transition data need to be obtained for open-shell atoms and ions. The spin-angular part for these matrix elements is typically based on standard quantities such as matrix elements of the unit tensor, the (reduced) coefficients of fractional parentage as well as a number of other reduced matrix elements concerning various products of electron creation ... Title of program: RACAH Catalogue Id: ADFV_v8_0 [ADUR] Nature of problem The accurate computation of atomic properties and level structures requires a good understanding and implementation of the atomic shell model and, hence, a fast and reliable access to its standard quantities. Apart from various coefficients of fractional parentage and the reduced matrix elements of the unit tensors, these qualities include the so-called spin-angular coefficients, i.e. the spin-angular parts of the many-electron matrix elements of physical operators, taken in respect of a basis o ... Versions of this program held in the CPC repository in Mendeley Data ADFV_v1_0; Racah; 10.1016/S0010-4655(97)00032-5 ADFV_v2_0; Racah; 10.1016/S0010-4655(98)00021-6 ADFV_v3_0; RACAH; 10.1016/S0010-4655(00)00234-4 ADFV_v4_0; RACAH; 10.1016/S0010-4655(01)00218-1 ADFV_v5_0; RACAH; 10.1016/S0010-4655(01)00219-3 ADFV_v6_0; RACAH; 10.1016/S0010-4655(02)00591-X ADFV_v7_0; RACAH; 10.1016/S0010-4655(03)00227-3 ADFV_v8_0; RACAH; 10.1016/j.cpc.2004.11.003 ADFV_v9_0; RACAH; 10.1016/j.cpc.2005.12.008 ADFV_v10_0; RACAH; 10.1016/j.cpc.2009.06.018 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)



Computational Physics, Computer Algebra System, Computational Method