Abstract
The thermally activated annealing of topological Stone–Wales defects in carbon fullerenes and nanotubes is studied via molecular dynamics. The temperature dependences of characteristic times are shown to obey the Arrhenius law. The values of the relevant activation energies and frequency factors are found. The results are compared with the simulated potential energy surface data.
This is a preview of subscription content, log in via an institution to check access.
Similar content being viewed by others
References
H. W. Kroto, J. R. Heath, S. C. O’Brien, R. F. Curl, and R. E. Smalley, Nature 318, 162 (1985).
S. Iijima, Nature 354, 56 (1991).
K. S. Novoselov, A. K. Geim, S. V. Morozov, D. Jiang, Y. Zhang, S. V. Dubonos, I. V. Grigorieva, and A. A. Firsov, Science 306, 666 (2004).
L. A. Openov and A. I. Podlivaev, Phys. Solid State 58, 1705 (2016).
A. J. Stone and D. J. Wales, Chem. Phys. Lett. 128, 501 (1986).
L. A. Openov and A. I. Podlivaev, JETP Lett. 84, 68 (2006).
Q. Lu and B. Bhattacharya, Nanotechnology 16, 555 (2005).
L. Pan, Z. Shen, Y. Jia, and X. Dai, Physica B 407, 2763 (2012).
D. Tasis, N. Tagmatarchis, A. Bianco, and M. Prato, Chem. Rev. 106, 1105 (2006).
C. Wang, G. Zhou, H. Liu, and W. Duan, J. Phys. Chem. B 110, 10266 (2006).
S. S. Moliver, R. R. Zimagullov, and A. L. Semenov, Tech. Phys. Lett. 37, 678 (2011).
M. M. Maslov, A. I. Podlivaev, and K. P. Katin, Mol. Simul. 42, 305 (2016).
K. P. Katin, V. S. Prudkovskiy, and M. M. Maslov, Physica E 81, 1 (2016).
L. A. Openov and A. I. Podlivaev, JETP Lett. 104, 193 (2016).
L. A. Openov and A. I. Podlivaev, Phys. Solid State 58, 847 (2016).
M. M. Maslov and K. P. Katin, Chem. Phys. Lett. 644, 280 (2016).
L. A. Openov and A. I. Podlivaev, Tech. Phys. Lett. 36, 31 (2010).
J.-Y. Yi and J. Bernholc, J. Chem. Phys. 96, 8634 (1992).
R. L. Murry, D. L. Strout, G. K. Odom, and G. E. Scuseria, Nature 366, 665 (1993).
R. L. Murry, D. L. Strout, and G. E. Scuseria, Int. J. Mass Spectrom. Ion Proc. 138, 113 (1994).
B. R. Eggen, M. I. Heggie, G. Jungnickel, C. D. Latham, R. Jones, and P. R. Briddon, Science 272, 87 (1996).
Y. Kumeda and D. J. Wales, Chem. Phys. Lett. 374, 125 (2003).
H. F. Bettinger, B. I. Yakobsen, and G. E. Scuseria, J. Am. Chem. Soc. 125, 5572 (2003).
G. V. Vineyard, J. Phys. Chem. Solids 3, 121 (1957).
A. I. Podlivaev and L. A. Openov, JETP Lett. 81, 533 (2005).
E. Ertekin, D. C. Chrzan, and M. S. Daw, Phys. Rev. B 79, 155421 (2009).
M. Kabir and K. J. van Vliet, J. Phys. Chem. C 120, 1989 (2016).
L. G. Zhou and S.-Q. Shi, Appl. Phys. Lett. 83, 1222 (2003).
J.-Y. Yi and J. Bernholc, Chem. Phys. Lett. 403, 359 (2005).
A. J. M. Nascimento and R. W. Nunes, Nanotechnology 24, 435707 (2013).
Author information
Authors and Affiliations
Corresponding author
Additional information
Original Russian Text © A.I. Podlivaev, L.A. Openov, 2018, published in Fizika Tverdogo Tela, 2018, Vol. 60, No. 1, pp. 160–164.
Rights and permissions
About this article
Cite this article
Podlivaev, A.I., Openov, L.A. Thermal annealing of Stone–Wales defects in fullerenes and nanotubes. Phys. Solid State 60, 162–166 (2018). https://doi.org/10.1134/S1063783418010183
Received:
Published:
Issue Date:
DOI: https://doi.org/10.1134/S1063783418010183