Publikation: A combined experimental and theoretical study of 1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene adsorption on Au(111)
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2021
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Lokamani, Mani
Kelling, Jeffrey
Ohmann, Robin
Meyer, Jörg
Kühne, Tim
Cuniberti, Gianaurelio
Zahn, Peter
Moresco, Francesca
et al.
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Surface Science. Elsevier. 2021, 712, 121877. ISSN 0039-6028. eISSN 1879-2758. Available under: doi: 10.1016/j.susc.2021.121877
Zusammenfassung
The electronic and geometrical structure of 1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene (PEEB) molecules adsorbed on a Au(111) surface is investigated by low temperature scanning tunneling microscopy (STM) and scanning tunneling spectroscopy (STS) in conjunction with density-functional-based tight-binding (DFTB) simulations of the density of states and the interaction with the substrate. Our density functional theory calculations indicate that the PEEB molecule is physisorbed on the Au(111) substrate, with negligible distortion of the molecular geometry and charge transfer between molecule and substrate.
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LOKAMANI, Mani, Jeffrey KELLING, Robin OHMANN, Jörg MEYER, Tim KÜHNE, Gianaurelio CUNIBERTI, Jannic WOLF, Thomas HUHN, Peter ZAHN, Francesca MORESCO, 2021. A combined experimental and theoretical study of 1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene adsorption on Au(111). In: Surface Science. Elsevier. 2021, 712, 121877. ISSN 0039-6028. eISSN 1879-2758. Available under: doi: 10.1016/j.susc.2021.121877BibTex
@article{Lokamani2021combi-54436,
year={2021},
doi={10.1016/j.susc.2021.121877},
title={A combined experimental and theoretical study of 1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene adsorption on Au(111)},
volume={712},
issn={0039-6028},
journal={Surface Science},
author={Lokamani, Mani and Kelling, Jeffrey and Ohmann, Robin and Meyer, Jörg and Kühne, Tim and Cuniberti, Gianaurelio and Wolf, Jannic and Huhn, Thomas and Zahn, Peter and Moresco, Francesca},
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