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Divalent admixtures to the trivalent ground-state configurations of Pr and Nd in transition-metal compounds
13
Citations
26
References
2002
Year
Localized Excited StateEngineeringTransition-metal CompoundsChemistryElectronic Excited StateElectronic StructureAbsorption ThresholdSingle-impurity Anderson ModelElectron SpectroscopyQuantum MaterialsMaterials ScienceInorganic ChemistryPhysicsChemical BondDivalent AdmixturesQuantum ChemistryExcited State PropertyNatural SciencesApplied PhysicsCondensed Matter PhysicsTrivalent Ground-state ConfigurationsEnergy PositionMetal Chain Compound
Resonant photoemission spectra at the $3\stackrel{\ensuremath{\rightarrow}}{d}4f$ absorption threshold are presented for some Pr and Nd transition-metal compounds. It is shown that the shape of spectra varies strongly with the composition of the compounds. Hybridization of the $4f$ electrons with valence-band states can lead to giant effects resulting in energy splittings of $4f$ emission by several electron volts. The phenomena are described quantitatively in the framework of a single-impurity Anderson model. Large splittings of the $4f$ emission are obtained if the energy position of the bare $4f$ state coincides with maxima of the valence-band density of states. For the ${4f}^{n}$ ground states, admixtures of ${4f}^{n+1}$ states of the order of some percent are obtained. Contributions of valence states to the resonant photoemission process are discussed.
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