On the electronic and transport properties of semiconducting carbon nanotubes: the role of sp3-defects

Research output: Contribution to journalResearch articleContributedpeer-review

Abstract

The effect of sp3-defects on the electronic and transport properties of semiconducting carbon nanotubes has been systematically studied on the basis of a quantum mechanical tight-binding model. We have calculated the band structure for carbon nanotubes with ordered defect patterns showing a large impact on the bandgap energy whereas for randomly distributed defects the band structure remains relatively robust. The transport behavior has been studied on the basis of the Green’s function method. The results indicate that the conductance of defective carbon nanotubes strongly depends on the number of defects and the tube diameter. We further show that the transport properties can be classified, depending on the number of defects, into two regimes which are either characterized by the mean-free path or the localization length. For both, analytical equations describing the impact of the tube diameter as well as the number of defects are derived. Comparing these values with the channel length indicates the dominant transport regime.

Details

Original languageEnglish
Pages (from-to)521–530
JournalJournal of Computational Electronics
Volume17
Publication statusPublished - 2018
Peer-reviewedYes

External IDs

Scopus 85042103436

Keywords

Keywords

  • Carbon nanotubes, Transport, Tight-binding, Effective band structure, Green’s function, Defects