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Valence force model for phonons in graphene and carbon nanotubes

  • IBM

Research output: Contribution to journalArticlepeer-review

61 Scopus citations

Abstract

Many calculations require a simple classical model for the interactions between s p2 -bonded carbon atoms, as in graphene or carbon nanotubes. Here we present a valence force model to describe these interactions. The calculated phonon spectrum of graphene and the nanotube breathing-mode energy agree well with experimental measurements and with ab initio calculations. The model does not assume an underlying lattice, so it can also be directly applied to distorted structures. The characteristics and limitations of the model are discussed.

Original languageEnglish
Article number241409
JournalPhysical Review B - Condensed Matter and Materials Physics
Volume79
Issue number24
DOIs
StatePublished - Jun 30 2009

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