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Orientationally ordered states in solid C60

J. Q. You, Tiansheng Xie, and B. Y. Tang
Phys. Rev. B 51, 1358(R) – Published 1 January 1995
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Abstract

We study the orientational ordering of the fullerene molecules in solid C60 with a phenomenological model proposed by Lu, Li, and Martin [Phys. Rev. Lett. 68, 1551 (1992)]. It is shown that the energy of a particular configuration is sensitive to the bond length of the fullerene molecule and there is an orientation that might explain the orientational disorders in solid C60. Also, the experimentally observed superstructure is investigated. Numerical calculations show that the orientational ordering of the fullerene molecules will induce structural deformation in the superstructure.

  • Received 17 October 1994

DOI:https://doi.org/10.1103/PhysRevB.51.1358

©1995 American Physical Society

Authors & Affiliations

J. Q. You

  • China Center of Advanced Science and Technology (World Laboratory), P.O. Box 8730, Beijing 100080, China
  • Laboratory of Atomic Imaging of Solids, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110015, China;
  • Department of Physics, Xiangtan University, Xiangtan 411105, Hunan, China

Tiansheng Xie

  • Laboratory of Atomic Imaging of Solids, Institute of Metal Research, Chinese Academy of Sciences, Shenyang 110015, China

B. Y. Tang

  • Department of Physics, Xiangtan University, Xiangtan 411105, Hunan, China

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Vol. 51, Iss. 2 — 1 January 1995

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