2005
DOI: 10.1103/physrevlett.94.015503
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Room Temperature Peierls Distortion in Small Diameter Nanotubes

Abstract: By means of ab initio simulations, we investigate the phonon band structure and electron-phonon coupling in small 4-A diameter nanotubes. We show that both the C(5,0) and C(3,3) tubes undergo above room temperature a Peierls transition mediated by an acoustical long wavelength and an optical q=2k(F) phonon, respectively. In the armchair geometry, we verify that the electron-phonon coupling parameter lambda originates mainly from phonons at q=2k(F) and is strongly enhanced when the diameter decreases. These res… Show more

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Cited by 146 publications
(164 citation statements)
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“…at other no other unique t noteworthy is the G band (i.e., the in-plane mode) from each of the two metallic a single, narrow, resonance-enhanced k at 1582 cm (6,6) and 1587 cm s observation is consistent with results obtained from single- 29 on a e mixture. 30 on of single-chirality armchair tubes, removed the problem of limited statistical samassociated with single-nanotube measurements and the n from semiconducting tubes in the nanomeasurements.…”
Section: Optical Absorption and Colors Of Armchair Carbon Nanotubessupporting
confidence: 81%
See 1 more Smart Citation
“…at other no other unique t noteworthy is the G band (i.e., the in-plane mode) from each of the two metallic a single, narrow, resonance-enhanced k at 1582 cm (6,6) and 1587 cm s observation is consistent with results obtained from single- 29 on a e mixture. 30 on of single-chirality armchair tubes, removed the problem of limited statistical samassociated with single-nanotube measurements and the n from semiconducting tubes in the nanomeasurements.…”
Section: Optical Absorption and Colors Of Armchair Carbon Nanotubessupporting
confidence: 81%
“…Mishchenko and Starykh 21 predict that optical absorption between the linear band and the first massive band (the so-called E M 01 or E M 10 transition) is enhanced, compared to the non-interacting case, and develops a power-law frequency dependence ∝ (ω−∆) −γ , where γ ≈ 0.2 for typical nanotubes. [27][28][29][30] Such predictions provide the theoretical impetus for experimentally probing nonequilibrium many-body responses driven through optical excitations and other quantum effects in armchair SWCNTs. At the same time, as exceptionally conductive wires, exhibiting ballistic conduction even at room temperature, [31][32][33] they are promising for a variety of electronic applications.…”
Section: Introductionmentioning
confidence: 99%
“…We will see that the strong reduction of the Coulomb interaction leads then to the prevalence of charge instabilities with similar character to the WentzelBardeen singularity. 27 We may compare the results of our investigation with those obtained for the small-diameter zigzag nanotubes by means of ab initio simulations 28 and mean-fieldlike calculations. 29 In Ref.…”
Section: Introductionmentioning
confidence: 99%
“…Because of their unique electrical, mechanical and thermodynamic properties, these cylindrical tubes are finding use in a wide variety of applications [1][2][3][4][5][6][7].SWCNTs in particular, show fundamental phenomena ranging from possible superconductivity [8] or Luttinger-liquid state [9] to Peierls distortion [10].This paper reports a spectroscopic study on a zigzag singlewalled carbon nanotube. The work presented in this paper develops an insight into the phonon dispersion, normal modes of vibration, Raman spectra and IR spectra of a zigzag singlewalled carbon-nanotube using Cambridge Sequential Total Energy Package (CASTEP) Module of the Material Studio software version 7.0.…”
Section: Introductionmentioning
confidence: 99%