Please use this identifier to cite or link to this item: http://essuir.sumdu.edu.ua/handle/123456789/37209
Title: New 1D and 2D Nanoscaled Materials Based on the Tetraoxa[8]circulene Monomer
Authors: Karaush, N.N.
Baryshnikov, G.V.
Minaev, B.F.
Keywords: Tetraoxa[8]circulene
Density functional theory
Nanotubes
Hole/electron mobility
Reorganization energy
Cyclooctatetraene core
Ambipolar semiconductors
Issue Year: 2014
Publisher: Sumy State University
Citation: Proc. NAP 3, 01CBNM01 (2014)
Abstract: New one- and two-dimensional p-conjugated materials containing a tetraoxa[8]circulene monomer are theoretically predicted on the basis of density functional theory techniques. These novel materials are predicted to demonstrate a promising hole/electron mobility properties which are typical for the ambipolar organic semiconductors. Furthermore, the growth of p-conjugation determines the strong visible light absorption of the studied systems in a great contrast to the initial lack of color of the tetraoxa[8]circulene compound. The synthesis of these new organic p-conjugated materials is an important task because of their potential practical applications in optoelectronic devices.
URI: http://essuir.sumdu.edu.ua/handle/123456789/37209
Type: Article
Appears in Collections:Наукові видання (ЕлІТ)

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