A fixed core Hartree-Fock program for calculating bound and continuum orbitals

Published: 1 January 1974| Version 1 | DOI: 10.17632/cdh75prr2b.1
G.N. Bates


Title of program: FIXED CORE HARTREE-FOCK Catalogue Id: ACRX_v1_0 Nature of problem Numerical fixed core or frozen core Hartree-Fock results are determined for one bound or continuum orbital of an atom. Versions of this program held in the CPC repository in Mendeley Data ACRX_v1_0; FIXED CORE HARTREE-FOCK; 10.1016/0010-4655(74)90098-8 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)