Finite-Length Models of Carbon Nanotubes Based on Clar Sextet Theory (Articolo in rivista)

Type
Label
  • Finite-Length Models of Carbon Nanotubes Based on Clar Sextet Theory (Articolo in rivista) (literal)
Anno
  • 2007-01-01T00:00:00+01:00 (literal)
Alternative label
  • Baldoni M.; Sgamellotti A.; Mercuri F. (2007)
    Finite-Length Models of Carbon Nanotubes Based on Clar Sextet Theory
    in Organic letters (Print)
    (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#autori
  • Baldoni M.; Sgamellotti A.; Mercuri F. (literal)
Pagina inizio
  • 4267 (literal)
Pagina fine
  • 4270 (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#numeroVolume
  • 9 (literal)
Rivista
Note
  • ISI Web of Science (WOS) (literal)
Http://www.cnr.it/ontology/cnr/pubblicazioni.owl#affiliazioni
  • 1. CNR, Dept Chem, ISTM, I-06123 Perugia, Italy 2. Univ Perugia, UDR INSTM, I-06123 Perugia, Italy (literal)
Titolo
  • Finite-Length Models of Carbon Nanotubes Based on Clar Sextet Theory (literal)
Abstract
  • Finite-length models of metallic and semiconducting carbon nanotubes (CNTs) based on Clar sextet theory of aromatic systems are proposed. For metallic CNTs, the electronic properties of finite-length models converge monotonically to the values expected for quasi-monodimensional metallic systems. For semiconducting CNTs, the use of finite-length models as proposed in this work leads to a fast convergence of the electronic properties to the values expected for the corresponding infinite-length nanotube. (literal)
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