Hartree-Fock Results for Some Excited States of , , and
- 15 March 1965
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 137 (6A), A1644-A1648
- https://doi.org/10.1103/physrev.137.a1644
Abstract
Hartree-Fock results are reported for some excited states of , , and , all of which involve two incomplete groups. The off-diagonal energy parameters included in the calculation turn out to be large in some cases. A procedure is suggested for dealing with nondiagonal terms in the Hamiltonian.
Keywords
This publication has 25 references indexed in Scilit:
- Theoretical Investigation of Some Magnetic and Spectroscopic Properties of Rare-Earth IonsPhysical Review B, 1962
- Accurate Analytical Self-Consistent Field Functions for Atoms. II. Lowest Configurations of the Neutral First Row AtomsPhysical Review B, 1962
- Hartree-Fock Atomic-Wave Functions for Ions of p, 5, cl, and aThe Astrophysical Journal Supplement Series, 1962
- Hartree-Fock Wave Functions for the-Shell AtomsPhysical Review B, 1961
- Analytic Hartree-Fock Wave Functions for the-Shell AtomsPhysical Review B, 1961
- Wave Functions and Correlation Energies for F, F—, and NeThe Journal of Chemical Physics, 1961
- Iron Series Hartree-Fock Calculations. IIPhysical Review B, 1960
- Iron Series Hartree-Fock CalculationsPhysical Review B, 1960
- Analytical Self-Consistent Field Functions for the Atomic Configurations , , andReviews of Modern Physics, 1960
- Radial wave functions with exchange for Va2+, Kr and Ag+Proceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1958