Paper Title:
Electronic Structures of Oligomers of Pyrrole
  Abstract

The electronic structures of oligomers of pyrrole have been calculated using the extended Hückel tight-binding program. The energy diagrams are shown for oligomers as the number of the repeating unit in the oligomers increases from 1 to 16. The relationship between the energy gap of the oligomers and the number of the repeating unit in the oligomers is established. Blue-green photoluminescence and electroluminescence from one-dimensional polypyrrole are predicted.

  Info
Periodical
Materials Science Forum (Volumes 663-665)
Edited by
Yuan Ming Huang
Pages
658-661
DOI
10.4028/www.scientific.net/MSF.663-665.658
Citation
B. G. Zhai, Q. L. Ma, Y. M. Huang, "Electronic Structures of Oligomers of Pyrrole", Materials Science Forum, Vols. 663-665, pp. 658-661, 2011
Online since
November 2010
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