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1 PublicationData publication: Describing chain-like assembly of ethoxygroup-functionalized organic molecules on Au(111) using high-throughput simulations
Lokamani, M.; Kelling, J.; Ohmann, R.; Meyer, J.; Kühne, T.; Cuniberti, G.; Wolf, J.; Juckeland, G.; Huhn, T.; Zahn, P.; Moresco, F.; Gemming, S.
Bei diesem Datensatz handelt es sich um die Grundzustandsstruktur von PEEB auf Au(111) und die Inputdatei für DFTB+.
Keywords: DFTB; 1,4-bis(phenylethynyl)-2,5-bis(ethoxy)benzene (PEEB); STM; High-Throughput; Meta-Structures
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- DOI: 10.1038/s41598-021-93724-5 references this (Id 33955) publication
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Describing chain-like assembly of ethoxygroup-functionalized organic molecules …
ROBIS: 32816 has used this (Id 33955) publication of HZDR-primary research data
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Reseach data in the HZDR data repository RODARE
Publication date: 2022-01-12 Open access
DOI: 10.14278/rodare.1374
Versions: 10.14278/rodare.1375
License: CC-BY-4.0
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Permalink: https://www.hzdr.de/publications/Publ-33955
Publ.-Id: 33955