On induced current density in the perylene/bisanthrene homologous series

Please use this identifier to cite or link to this item: https://scidar.kg.ac.rs/handle/123456789/10471

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DC Field	Value	Language
dc.contributor.author	Radenkovic, Slavko	-
dc.contributor.author	Bultinck P.	-
dc.contributor.author	Gutman I.	-
dc.contributor.author	Đurđević Nikolić, Jelena	-
dc.date.accessioned	2021-04-20T15:50:22Z	-
dc.date.available	2021-04-20T15:50:22Z	-
dc.date.issued	2012	-
dc.identifier.issn	0009-2614	-
dc.identifier.uri	https://scidar.kg.ac.rs/handle/123456789/10471	-
dc.description.abstract	Induced current densities, calculated at the coupled HF level of theory, using the CTOCD-DZ method, are studied in the homologous series of benzenoid hydrocarbons whose first members are perylene, bisanthrene, and tetrabenzo[bc,ef,kl,no]coronene. In the first three members of this series, current density is in good agreement with the predictions of a recently proposed Kekulé-structure-based model (M. Randić, Chem. Phys. Lett. 500 (2010) 123). In higher members, the current density significantly deviates from this model. © 2012 Elsevier B.V. All rights reserved.	-
dc.rights	restrictedAccess	-
dc.source	Chemical Physics Letters	-
dc.title	On induced current density in the perylene/bisanthrene homologous series	-
dc.type	article	-
dc.identifier.doi	10.1016/j.cplett.2012.09.055	-
dc.identifier.scopus	2-s2.0-84868198906	-
Appears in Collections:	Faculty of Science, Kragujevac

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