The Journal of Physical Chemistry A · 2010 · 39 citations · 39 references
Natural SciencesChemistryMaterials ScienceCrystal StructureQuantum ChemistrySpectroscopyCoordination NumberCrystal ChemistryMolecular Orbital TheoryTransition Metal ComplexesX-ray CrystallographyX-ray SpectroscopyChemical QuantitiesElectronic Structure DeterminationMolecular Orbital AnalysisMolecular Orbital DiagramsX-ray Absorption Near Edge StructureX-ray Absorption SpectroscopyX-ray Chemistry
A peak appearing at the L(2,3) X-ray absorption edge often provides the number of empty d states of the X-ray absorbing atoms. Ag(+) compounds have a d(10) state (no d empty states) but show a small peak at the edge. In this research, we systematically studied the edge peak of Ag(+) compounds to understand its origin on the basis of the molecular orbital picture and to obtain a relation of the edge peak intensity to chemical and physical quantities. The edge peak can be formally assigned to the transition from 2p to 5s enhanced by the s-d hybridization. The peak intensity has a negative correlation with a coordination charge but has a positive correlation with the strength of the covalent bond, which is in the reverse order to the other d(n) (n < 10) elements.
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<b>Hard and Soft Acids and Bases</b>
Ralph G. Pearson · Journal of the American Chemical Society · 1963 · 10.2K citations
F. W. Lytle, P. S. Wei, R.B. Greegor et al. · The Journal of Chemical Physics · 1979 · 298 citations
Natural Sciences, Chemistry, Physics +17