THE ORTHOGONALITY ASSUMPTION IN THE HARTREE–FOCK APPROXIMATION

1 January 1967

journal article
Published by Canadian Science Publishing in Canadian Journal of Physics

Vol. 45 (1) , 7-12
https://doi.org/10.1139/p67-002

Abstract

Several procedures are considered for maintaining orthogonality between one-electron functions of the nsn's¹S excited states as well as orthogonality to a lower state. The results are compared with those obtained without any orthogonality constraints.

Keywords

FOCK APPROXIMATION
FUNCTIONS
CONSTRAINTS
PROCEDURES
EXCITED
HARTREE
ORTHOGONALITY ASSUMPTION
NSN'S1S

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