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    Electronic Properties and Reactivities of Perfect, Defected, and Doped Single-Walled Carbon Nanotubes

    After we thoroughly surveyed first-principles theoretical methods commonly employed in the studies of carbon nanotubes, we highlighted the performance of such ab inito methods on the electronic properties and rea...

    Wei Quan Tian, Lei Vincent Liu, Ya Kun Chen… in Trends in Computational Nanomechanics (2010)