The Journal of Chemical Physics · 1962 · 75 citations · 5 references
Natural SciencesChemistryPhysicsPhysical ChemistrySpectroscopyTheoretical ChemistryAb Initio MethodsDensity Functional TheoryElectronic Band StructureMolecular ModelingMolecular Orbital TheoryAlkali Metal ChemistryHeitler-london TheoryMolecular Orbital AnalysisMolecular Orbital Theory In Electron TransferPhosphorsQuantum Chemical ModelingSpectral Absorption Bands
It is pointed out that the Seitz model may be interpreted as a molecular-orbital model. This enables us to avoid some difficulties encountered in the interpretation within a Heitler-London framework. It is demonstrated that the observed positions of the A, B, and C absorption bands and the observed ratio of the dipole strength of the C band to that of the A band are consistent with each other in the molecular orbital model for KCl:Tl, KI:Tl, and also for KCl:In with some reservation.
5
Configuration Interaction in Alkali Halide Phosphors
Robert S. Knox · Physical Review · 1959 · 78 citations
Natural Sciences, Chemistry, Physics +16
Solid State Luminescence Theory and Oscillator Strengths in KCl: Tl
Robert S. Knox, D. L. Dexter · Physical Review · 1956 · 53 citations
Natural Sciences, Chemistry, Physics +13