"Inverted'' porphyrins: a distorted adsorption geometry of free-base porphyrins on Cu(111)

Journal article


Publication Details

Author(s): Lepper M, Köbl J, Schmitt T, Gurrath M, De Siervo A, Schneider MA, Steinrück HP, Meyer B, Marbach H, Hieringer W
Journal: Chemical Communications
Publisher: ROYAL SOC CHEMISTRY
Publication year: 2017
Volume: 53
Journal issue: 58
Pages range: 8207-8210
ISSN: 1359-7345


Abstract


Based on density functional theory calculations combined with experimental results, we report and discuss an extremely distorted, "inverted'' adsorption geometry of free-base tetraphenylporphyrin on Cu(111). The current findings yield new insights into a wellstudied system, shedding light on the peculiar molecule-substrate interaction and the resulting intramolecular conformation.



FAU Authors / FAU Editors

Gurrath, Martin
Schneider, M. Alexander Prof. Dr.
Interdisziplinäres Zentrum für Molekulare Materialien
Hieringer, Wolfgang PD Dr.
Lehrstuhl für Theoretische Chemie
Köbl, Julia
Lehrstuhl für Physikalische Chemie II
Lepper, Michael
Lehrstuhl für Physikalische Chemie II
Marbach, Hubertus PD Dr.
Lehrstuhl für Physikalische Chemie II
Meyer, Bernd Prof. Dr.
Professur für Computational Chemistry
Schmitt, Tobias
Lehrstuhl für Festkörperphysik
Professur für Experimentalphysik
Steinrück, Hans-Peter Prof. Dr.
Lehrstuhl für Physikalische Chemie II


Additional Organisation
Exzellenz-Cluster Engineering of Advanced Materials


External institutions with authors

Universidade Estadual de Campinas (UNICAMP) / University of Campinas


Research Fields

D Catalytic Materials
Exzellenz-Cluster Engineering of Advanced Materials
A3 Multiscale Modeling and Simulation
Exzellenz-Cluster Engineering of Advanced Materials


How to cite

APA:
Lepper, M., Köbl, J., Schmitt, T., Gurrath, M., De Siervo, A., Schneider, M.A.,... Hieringer, W. (2017). "Inverted'' porphyrins: a distorted adsorption geometry of free-base porphyrins on Cu(111). Chemical Communications, 53(58), 8207-8210. https://dx.doi.org/10.1039/c7cc04182a

MLA:
Lepper, Michael, et al. ""Inverted'' porphyrins: a distorted adsorption geometry of free-base porphyrins on Cu(111)." Chemical Communications 53.58 (2017): 8207-8210.

BibTeX: 

Last updated on 2019-18-07 at 07:29

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