Concepedia

Electronic structure of UF6−

Michael Boring, J. H. Wood, Jules W. Moskowitz

The Journal of Chemical Physics · 1974 · 51 citations · 9 references

DOI

Concepts

Abstract

The SCF-X α-SW method is used to carry out an approximate Hartree-Fock calculation on the electronic structure on UF6−. The charge density within the atomic spheres is analyzed into its angular momentum components and the first two excited electronic states are computed.

References

9

Optimization of the Statistical Exchange Parameter<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>α</mml:mi></mml:math>for the Free Atoms H through Nb

Karlheinz Schwarz · Physical review. B, Solid state · 1972 · 1.2K citations

, , +17

Self-Consistent-Field<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>X</mml:mi><mml:mi>α</mml:mi></mml:math>Cluster Method for Polyatomic Molecules and Solids

J. C. Slater, K. H. Johnson · Physical review. B, Solid state · 1972 · 912 citations

, , +16

On the magnetic properties of covalent <i>XY</i> 6 complexes

K W H Stevens · Proceedings of the Royal Society of London A Mathematical and Physical Sciences · 1953 · 336 citations

, , +17

On the use of overllapping spheres in the SCF Xα scattered-wave method

Notker Rösch, W. G. Klemperer, K. H. Johnson · Chemical Physics Letters · 1973 · 152 citations

, , +2

Electron paramagnetic resonance and optical studies of pentavalent uranium

W. Lewis, Harry G. Hecht, Michael P. Eastman · Inorganic Chemistry · 1973 · 36 citations

, , +8