Correlation of electronic and local structure of 4-hydroxy-thiophenol on NaCl(100) and Ag(100)

Tegenkamp, Christoph; Pfnür, Herbert

Original version

Tegenkamp, C.; Pfnür, H.: Correlation of electronic and local structure of 4-hydroxy-thiophenol on NaCl(100) and Ag(100). In: Journal of Chemical Physics 118 (2003), Nr. 16, S. 7578-7584. DOI: https://doi.org/10.1063/1.1562193

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Abstract:
The results of the electronic structure of HTP on NaCl(100) and on poly-Ag(100) obtained with UPS and EELS are presented. Due to the relatively weak interactions of HTP on both surfaces studied, and the low saturation densities in the first monolayers, the information from calculations of single isolated molecules turned out to be sufficient. It is seen that for stronger interactions with the substrate these must also be taken into account.
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Publication type:	Article
Publishing status:	publishedVersion
Publication date:	2003
Keywords english:	Adsorption, Binding energy, Chemical bonds, Electron energy loss spectroscopy, Electronic structure, Molecules, Morphology, Photoelectron spectroscopy, Probability density function, Silver, Sodium chloride, Van der Waals forces, Hydroxy-thiophenol, Molecular adsorption, Molecular emissions, Restricted configuration interaction singles, van der Waals interaction, Organic compounds
DDC:	530 \| Physik