Self-consistent field hartree-fock program for atoms
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资源简介:
Title of program: ATOMIC SCF HARTREE-FOCK
Catalogue Id: AAKQ_v1_0
Nature of problem
The present program calculates one-electron radial wave function and energy eigenvalues by solving non-relativistic single-configuration Hartree-Fock (HF) equations for bound states of an atom.
Versions of this program held in the CPC repository in Mendeley Data
AAKQ_v1_0; ATOMIC SCF HARTREE-FOCK; 10.1016/0010-4655(76)90040-0
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
创建时间:
2019-11-11



