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Molecular-Dynamics Simulations Of Carbon Nanocage Structures: Nanoballs And Nanotoroids

Author

Listed:
  • ŞAKIR ERKOÇ

    (Department of Physics, Middle East Technical University, 06531 Ankara, Turkey)

  • DERVIŞ CAN VURAL

    (Department of Physics, Middle East Technical University, 06531 Ankara, Turkey)

Abstract

The structural stability of carbon nanocages, fullerens and toroids, have been investigated by performing molecular-dynamics computer simulations. The systems considered areC120andC240in ball and toroidal structures. Calculations have been realized by using an empirical many-body potential energy function for carbon. It has been found thatC120ball is very unstable, and the other structures are relatively more strong against heat treatment.

Suggested Citation

  • Şakir Erkoç & Derviş Can Vural, 2001. "Molecular-Dynamics Simulations Of Carbon Nanocage Structures: Nanoballs And Nanotoroids," International Journal of Modern Physics C (IJMPC), World Scientific Publishing Co. Pte. Ltd., vol. 12(05), pages 685-690.
    • Handle: RePEc:wsi:ijmpcx:v:12:y:2001:i:05:n:s0129183101001924
    DOI: 10.1142/S0129183101001924
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