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Broken symmetry approach and chemical susceptibility of carbon nanotubes
Authors:Elena F. Sheka  Leonid A. Chernozatonskii
Affiliation:1. Peoples' Friendship University of Russia, General Physics Department, Moscow 117198, Russia;2. Institute of Biochemical Physics, Russian Academy of Sciences, Moscow 119991, Russia
Abstract:
Keywords:carbon nanotubes  effectively unpaired electrons  broken symmetry unrestricted Hartree‐Fock approximation  chemical susceptibility  semiempirical quantum chemistry
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