Abstract
The effect of hydrogenation of (4, 0) and (3, 0) carbon nanotubes on the Stone–Wales transformation is studied in the framework of the nonorthogonal tight-binding model. It is shown that the atomic hydrogen adsorption can lead to both a decrease and an increase in the barriers for the direct and inverse transformations depending on the orientation of a rotating C–C bond with respect to the nanotube axis. The characteristic times of formation and annealing the Stone–Wales defects have been estimated. The Young’s moduli have been calculated.
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H. W. Kroto, J. R. Heath, S. C. O’Brien, R. F. Curl, and R. E. Smalley, Nature (London, U.K.) 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).
A. J. Stone and D. J. Wales, Chem. Phys. Lett. 128, 501 (1986).
B. R. Eggen, M. I. Heggie, G. Jungnickel, C. D. Latham, R. Jones, and P. R. Briddon, Science 272, 87 (1996).
Q. Lu and B. Bhattacharya, Nanotechnology 16, 555 (2005).
L. Pan, Z. Shen, Y. Jia, and X. Dai, Phys. B (Amsterdam, Neth.) 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).
R. Ansari, S. Ajori, and B. Motevalli, Superlatt. Microstruct. 51, 274 (2012).
S. N. Shirodkar and U. V. Waghmare, Phys. Rev. B 86, 165401 (2012).
S. S. Moliver, R. R. Zimagullov, and A. L. Semenov, Tech. Phys. Lett. 37, 678 (2011).
A. I. Podlivaev and L. A. Openov, Phys. Solid State 60 (2018, in press).
J.-Y. Yi and J. Bernholc, Chem. Phys. Lett. 403, 359 (2005).
A. J. M. Nascimento and R. W. Nunes, Nanotechnology 24, 435707 (2013).
A. I. Podlivaev and L. A. Openov, Phys. Solid State 57, 2562 (2015).
D. Stojkovic, P. Zhang, and V. H. Crespi, Phys. Rev. Lett. 87, 125502 (2001).
M. Kabir and K. J. van Vliet, J. Phys. Chem. C 120, 1989 (2016).
G. V. Vineyard, J. Phys. Chem. Solids 3, 121 (1957).
M. M. Maslov, A. I. Podlivaev, and K. P. Katin, Mol. Simul. 42, 305 (2016).
L. A. Openov and A. I. Podlivaev, Phys. Solid State 50, 1195 (2008).
K. P. Katin, V. S. Prudkovskiy, and M. M. Maslov, Phys. E (Amsterdam, Neth.) 81, 1 (2016).
L. A. Openov and A. I. Podlivaev, JETP Lett. 104, 193 (2016).
M. M. Maslov and K. P. Katin, Chem. Phys. Lett. 644, 280 (2016).
L. G. Zhou and S.-Q. Shi, Appl. Phys. Lett. 83, 1222 (2003).
L.-M. Peng, Z. L. Zhang, Z. Q. Xue, Q. D. Wu, Z. N. Gu, and D. G. Pettifor, Phys. Rev. Lett. 85, 3249 (2000).
T. C. Fitzgibbons, M. Guthrie, E. Xu, V. H. Crespi, S. K. Davidowski, G. D. Cody, N. Alem, and J. V. Badding, Nat. Mater. 14, 43 (2015).
R. E. Roman, K. Kwan, and S. W. Cranford, Nano Lett. 15, 1585 (2015).
C. D. Reddy, S. Rajendran, and K. M. Liew, Nanotechnology 17, 864 (2006).
E. Hernández, C. Goze, P. Bernier, and A. Rubio, Phys. Rev. Lett. 80, 4502 (1998).
O. E. Glukhova and O. A. Terent’ev, Phys. Solid State 48, 1411 (2006).
M. M. J. Treacy, T. W. Ebbesen, and J. M. Gibson, Nature (London, U.K.) 381, 678 (1996).
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Original Russian Text © L.A. Openov, A.I. Podlivaev, 2018, published in Fizika Tverdogo Tela, 2018, Vol. 60, No. 4, pp. 795–798.
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Openov, L.A., Podlivaev, A.I. Effect of Hydrogen Adsorption on the Stone–Wales Transformation in Small-Diameter Carbon Nanotubes. Phys. Solid State 60, 799–803 (2018). https://doi.org/10.1134/S1063783418040224
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DOI: https://doi.org/10.1134/S1063783418040224