Collectively Induced Quantum-Confined Stark Effect in Monolayers of Molecules Consisting of Polar Repeating Units

[Image: see text] The electronic structure of terpyrimidinethiols is investigated by means of density-functional theory calculations for isolated molecules and monolayers. In the transition from molecule to self-assembled monolayer (SAM), we observe that the band gap is substantially reduced, fronti...

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Detalles Bibliográficos
Autores principales: Rissner, Ferdinand, Egger, David A., Natan, Amir, Körzdörfer, Thomas, Kümmel, Stephan, Kronik, Leeor, Zojer, Egbert
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2011
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3217729/
https://www.ncbi.nlm.nih.gov/pubmed/21955058
http://dx.doi.org/10.1021/ja203579c

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3217729/
https://www.ncbi.nlm.nih.gov/pubmed/21955058
http://dx.doi.org/10.1021/ja203579c

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