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Author:

Yang, Wei (Yang, Wei.) | Wang, Ru-Zhi (Wang, Ru-Zhi.) (Scholars:王如志) | Wang, Yu-Fang (Wang, Yu-Fang.) | Song, Xue-Mei (Song, Xue-Mei.) | Wang, Bo (Wang, Bo.) (Scholars:王波) | Yan, Hui (Yan, Hui.)

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Scopus SCIE

Abstract:

Using molecular-dynamics simulations and the force-constant model, we have studied the Raman-active tangential modes (TMs) of a (10,0) single-wall carbon nanotube under hydrostatic pressure. With increasing pressure, the atomic motions in the three TMs present obvious diversities. The pressure derivative of E-1g, A(1g), and E-2g mode frequencies shows an increased value (d omega(E1g)/dP>0), a constant value (d omega(A1g)/dP similar to 0), and a negative value (d omega(E2g)/dP < 0) above 5.3 GPa, respectively. The intrinsic characteristics of TMs consumedly help us understand the essence of the experimental T band of CNT. The anomalous pressure behavior of the TM frequencies may originate from the tube symmetry alteration from D-10h to D-2h then to C-2h.

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Author Community:

  • [ 1 ] Beijing Univ Technol, Lab Thin Film Mat, Beijing 100022, Peoples R China
  • [ 2 ] Nankai Univ, Dept Phys, Tianjin 300071, Peoples R China

Reprint Author's Address:

  • 王如志

    [Wang, Ru-Zhi]Beijing Univ Technol, Lab Thin Film Mat, Beijing 100022, Peoples R China

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Source :

PHYSICAL REVIEW B

ISSN: 1098-0121

Year: 2007

Issue: 3

Volume: 76

3 . 7 0 0

JCR@2022

ESI Discipline: PHYSICS;

JCR Journal Grade:1

Cited Count:

WoS CC Cited Count: 13

SCOPUS Cited Count: 13

ESI Highly Cited Papers on the List: 0 Unfold All

WanFang Cited Count:

Chinese Cited Count:

30 Days PV: 1

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