Stability of the Restricted Hartree-Fock-Roothaan Method

Sigeru Huzinaga and Adrienne Hart-Davis
Phys. Rev. A 8, 1734 – Published 1 October 1973
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Abstract

Newly computed Hartree-Fock-Roothaan wave functions are reported for the atomic negative ions, B, C, N, O, Si, P, S. They are obtained as self-consistently convergent solutions. The implication with regard to the stability of the restricted Hartree-Fock-Roothan method is also discussed.

  • Received 19 March 1973

DOI:https://doi.org/10.1103/PhysRevA.8.1734

©1973 American Physical Society

Authors & Affiliations

Sigeru Huzinaga and Adrienne Hart-Davis

  • Department of Chemistry, The University of Alberta, Edmonton, Alberta, Canada

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Issue

Vol. 8, Iss. 4 — October 1973

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