Abstract
The dynamics of a Stone-Wales defect in graphene has been investigated using the computer simulation of its time evolution at different temperatures. The previously predicted thermally activated transitions between two energy-degenerate sinelike configurations of these defects have been directly demonstrated. The temperature dependence of the characteristic time of these transitions has been determined. Based on the analysis of the hypersurface of the potential energy, the activation energy and frequency factor in the Arrhenius law have been obtained.
Similar content being viewed by others
References
K. S. Novoselov, A. K. Geim, S. V. Morozov, D. Jiang, Y. Zhang, S. V. Dubonos, I. V. Grigorieva, and A. A. Firsov, Science (Washington) 306, 666 (2004).
A. J. Stone and D. J. Wales, Chem. Phys. Lett. 128, 501 (1986).
A. I. Podlivaev and L. A. Openov, JETP Lett. 81(10), 533 (2005).
L. A. Openov and A. I. Podlivaev, JETP Lett. 84(2), 68 (2006).
Yu. E. Lozovik and A. M. Popov, Phys.—Usp. 40(7), 717 (1997).
L. Chen, H. Hu, Yu. Quyang, H. Z. Pan, Y. Y. Sun, and F. Liu, Carbon 49, 3356 (2011).
J. C. Meyer, A. K. Geim, M. I. Katsnelson, K. S. Novoselov, T. J. Booth, and S. Roth, Nature (London) 446, 60 (2007).
E. Kaxiras and K. C. Pandey, Phys. Rev. Lett. 61, 2693 (1988).
H. Amara, S. Latil, V. Meunier, Ph. Lambin, and J.-C. Charlier, Phys. Rev. B: Condens. Matter 76, 115423 (2007).
J. Ma, D. Alfè, A. Michaelides, and E. Wang, Phys. Rev. B: Condens. Matter 80, 033407 (2009).
J. C. Meyer, C. Kisielowski, R. Erni, M. D. Rossell, M. F. Crommie, and A. Zettl, Nano Lett. 8, 3582 (2008).
L. A. Openov and A. I. Podlivaev, Phys. Solid State 50(6), 1195 (2008).
M. M. Maslov, A. I. Podlivaev, and L. A. Openov, Phys. Lett. A 373, 1653 (2009).
M. M. Maslov, A. I. Podlivaev, and L. A. Openov, Phys. Solid State 53(12), 2532 (2011).
X.-L. Sheng, H.-J. Cui, F. Ye, Q.-B. Yan, Q.-R. Zheng, and G. Su, J. Appl. Phys. 112, 074315 (2012).
V. F. Elesin, A. I. Podlivaev, and L. A. Openov, Phys. Low-Dimens. Struct. 11/12, 91 (2000).
A. I. Podlivaev and L. A. Openov, Phys. Solid State 48(11), 2226 (2006).
L. Li, S. Reich and J. Robertson, Phys. Rev. B: Condens. Matter 72, 184109 (2005).
G. H. Vineyard, J. Phys. Chem. Solids 3, 121 (1957).
A. I. Podlivaev and L. A. Openov, Phys. Solid State 55(12), 2592 (2013).
M. M. Maslov, L. A. Openov, and A. I. Podlivaev, Phys. Solid State 56(6), 1239 (2014).
A. A. El-Barbary, R. H. Telling, C. P. Ewels, M. I. Heggie, and P. R. Briddon, Phys. Rev. B: Condens. Matter 68, 144107 (2003).
A. W. Robertson, B. Montanari, K. He, C. S. Allen, Y. A. Wu, N. M. Harrison, A. I. Kirkland, and J. H. Warner, ACS Nano 7, 4495 (2013).
L. Chen, J. Li, D. Li, M. Wei, and X. Wang, Solid State Commun. 152, 1985 (2012).
Author information
Authors and Affiliations
Corresponding author
Additional information
Original Russian Text © A.I. Podlivaev, L.A. Openov, 2015, published in Fizika Tverdogo Tela, 2015, Vol. 57, No. 4, pp. 802–806.
Rights and permissions
About this article
Cite this article
Podlivaev, A.I., Openov, L.A. Dynamics of the Stone-Wales defect in graphene. Phys. Solid State 57, 820–824 (2015). https://doi.org/10.1134/S1063783415040265
Received:
Published:
Issue Date:
DOI: https://doi.org/10.1134/S1063783415040265