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American Physical Society, Physical Review B (Condensed Matter), 20(58), p. R13314-R13317, 1998

DOI: 10.1103/physrevb.58.r13314

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Effect of intertube coupling on the electronic structure of carbon nanotube ropes

Journal article published in 1998 by Young-Kyun Kwon ORCID, Susumu Saito, David Tománek
This paper is available in a repository.
This paper is available in a repository.

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Abstract

We calculate the structural and electronic properties of an ordered “bundle” of (10,10) carbon nanotubes. Our results indicate that intertube coupling causes an additional band dispersion of ≲0.2 eV and opens up a pseudogap of the same magnitude at EF. Soft librations at ν≈12 cm-1 are predicted to occur below the orientational melting temperature which marks the onset of tube rotations about their axis. Whereas the density of states near EF increases by 7% due to intertube coupling and by one order of magnitude due to K doping in KC8, these states do not couple to tube librations.