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- Schiessling, J, et al.
(författare)
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Insulating surface layer on single crystal K3C60
- 2004
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Ingår i: European Physical Journal B. Condensed Matter and Complex Systems. - : Springer Science and Business Media LLC. - 1434-6028. ; 41:4, s. 435-438
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Tidskriftsartikel (refereegranskat)abstract
- Using angle-dependent photoemission spectra of core and valence levels we show that metallic, single crystal K3C60 is terminated by an insulating or weakly-conducting surface layer. We attribute this to the effects of strong intermolecular correlations combined with the average surface charge state. Several controversies on the electronic structure are thereby resolved.
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- Öström, H., et al.
(författare)
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Orbital rehybridization in n-octane adsorbed on Cu(110)
- 2003
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Ingår i: Journal of Chemical Physics. - : American Institute of Physics. - 0021-9606. ; 118:8, s. 3782-3789
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Tidskriftsartikel (refereegranskat)abstract
- We have investigated the local electronic structure of n-octane adsorbed on the Cu(110) surface using symmetry-resolved x-ray absorption spectroscopy (XAS) and x-ray emission spectroscopy (XES) in combination with density functional theory (DFT) spectrum calculations. We found new adsorption-induced states in the XE spectra, which we assign to interaction between the bonding CH orbitals and the metal surface. By performing a systematic investigation of the influence of different structural parameters on the XA and XE spectra, we conclude that the molecular geometry is significantly distorted relative to the gas-phase structure. The bonding to the surface leads to a strengthening of the carbon–carbon bonds and a weakening of the carbon–hydrogen bonds, consistent with a rehybridization of the carbons from sp3 to sp2.8. ©2003 American Institute of Physics.
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