INFLUENCE OF IMPURITIES AND DEFECTS ON ELECTRONIC STRUCTURE OF CARBON NANOTUBES

  • A.P. POPOV
  • I.V. BAZHIN
Part of the NATO Security through Science Series A: Chemistry and Biology book series

Abstract

In frameworks of semi-empirical PM3-basis equilibrium configurations, total energy, heat of formation, energies of HOMO and LUMO orbitals, density of oneelectron states (DOS) of open (12,0) carbon nanotubes with local vacancies and defects are obtained.

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Copyright information

© Springer 2007

Authors and Affiliations

  • A.P. POPOV
    • 1
  • I.V. BAZHIN
    • 1
  1. 1.Department of education quality controlRostov State Pedagogical UniversityRostov-on-DonRussia

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