Search results for " photoemission"
showing 5 items of 65 documents
Valence-band electronic structure of CdO, ZnO, and MgO from x-ray photoemission spectroscopy and quasi-particle-corrected density-functional theory c…
2009
The valence-band density of states of single-crystalline rock-salt CdO(001), wurtzite $c$-plane ZnO, and rock- salt MgO(001) are investigated by high-resolution x-ray photoemission spectroscopy. A classic two-peak structure is observed in the VB-DOS due to the anion $2p$-dominated valence bands. Good agreement is found between the experimental results and quasi-particle-corrected density-functional theory calculations. Occupied shallow semicore $d$ levels are observed in CdO and ZnO. While these exhibit similar spectral features to the calculations, they occur at slightly higher binding energies, determined as 8.8 eV and 7.3 eV below the valence band maximum in CdO and ZnO, respectively. Th…
Circular dichroism in X-ray photoemission from Pd(111) and CO/Pd(111)
1995
It is shown experimentally that in the soft X-ray region a large circular dichroism in the photoelectron angular distribution (CDAD) exists for both valence orbitals and core levels of CO molecules adsorbed on Pd(111). From theoretical consideration it follows that in the case of a spherically symmetric ground state wave function, like the 1σ and 2σ orbitals of CO, CDAD appears due to the lack of spherical symmetry in the final state. For carbonK-shell experimental results are compared to model calculations. Investigations at the Pd core levels proved that CDAD does also arise in X-ray photo-emission from non-magnetic crystals.
Density-Functional Calculations of Auger and X-Ray Photoemission Shifts for Metallic Elements
1982
ΔSCF density-functional calculations are reported for Auger, and core level binding energy shifts in sp-bonded metals. The basic model, atom-in-jellium-vacancy, gives good agreement with experiment, especially in the Auger case. The chemical and relaxation contributions to the shifts are discussed. The shifts are calculated also by using the thermochemical model and the results obtained are in agreement with experimental data. The applicability of the "excited-atom" approach to the Auger energy shifts is found restricted.
Photon Energy Dependent Hard X-ray Photoemission Spectroscopy of YbCu2Si2
2012
We have performed photon energy ( h ν) dependent hard X-ray photoemission spectroscopy (HAXPES) for YbCu 2 Si 2 , which is a heavy Fermion compound with intermediate Yb valence. We identified that the bulk components in the Si 1 s and Yb 3 d spectra develop with increasing h ν from 2.5 to 6 keV. Moreover, the temperature dependence of the Yb 3 d spectra measured at h ν= 8 keV has shown a valence fluctuation behavior. These results suggest that high h ν HAXPES is essential to determine the mean valence of the Yb compounds.
Embedded-atom calculations of Auger and x-ray photoemission shifts for metallic elements
1982
Change in self-consistent-field energy density-functional calculations are reported for Auger and core-level binding-energy shifts in sp-bonded metals. The basic model, atom in jellium vacancy, gives good agreement with experiment, especially in the Auger case. The chemical and relaxation contributions to the shifts are discussed, and the extra-atomic response is analyzed in detail, both in position and energy space. The adequacy of the "excited-atom" approach to the energy shifts is discussed. Peer reviewed