Abstract
The equilibrium state of the C60@C450 nanoparticle was studied. The compound was found to be stable during the encapsulation of C60 tubelene. The motions of tubelene in the confinement potential field of a closed C450 nanotube, namely, the translational motion along the tubule axis and the rotational motion were investigated in detail. It is predicted that there is a nanogyroscope inside C450, rotating in the field of the C60 capsule. Its quantized rotational states were calculated. The nanoparticle structure and energy were investigated by the tight binding method using modified parameters.
Similar content being viewed by others
References
H. Kataura, Y. Maniwa, M. Fujiwara, et al., Appl. Phys. A, 74, 349–354 (2002).
O. Dubay and G. Kresse, Phys. Rev., 70, No. 16, 165424(1–10) (2004).
M. Otani, S. Okada, and A. Oshiyama, ibid., 68, No. 12, 125424(1–8) (2003).
K. Suenaga, T. Okazaki, K. Hirahara, et al., Appl. Phys. A, 76, 445–447 (2003).
E. G. Noya, D. Srivastava, L. A. Chernozatonskii, et al., Phys. Rev. B, 70, No. 11, 115416 (1–5) (2004).
L. A. Girifalco and M. Hodak, Appl. Phys. A, 76, No. 19, 487–498 (2003).
C. H. Lee, K. T. Kang, K. S. Park, et al., Jpn. Appl. Phys., 42, No. 8, 5392–5394 (2003).
M. Porto, M. Urbakh, and J. Klafter, Phys. Rev. Lett., 84, No. 26(I), 6058–6061 (2000).
O. E. Glukhova, A. I. Zhbanov, and A. G. Rezkov, Fiz. Tverd. Tela, 47, No. 2, 376–382 (2005).
M. Krause, M. Hulman, H. Kuzmany, et al., Phys. Rev. Lett., 93, No. 13, 137403(1–4) (2004).
L. Goodwin, J. Phys.: Condens. Matter, 3, 3869–3878 (1991).
N. V. Khokhryakov, S. S. Savinskii, and J. M. Molina, Pisma Zh. Éksp. Teor. Fiz., 62, No. 7, 595–598 (1995).
O. E. Glukhova and A. I. Zhbanov, Fiz. Tverd. Tela, 45, No. 1, 180–186 (2003).
J. R. D. Copley, D. A. Neumann, R. L. Cappelletti, and W. A. Kamitakahara, Phys. Chem. Solids, 53, No. 11, 1353–1371 (1992).
D. Qian, W. K. Liu, and R. S. Ruoff, J. Phys. Chem. B, 105, No. 44, 10753–10758 (2001).
O. E. Glukhova, A. A. Druzhinin, A. I. Zhbanov, and A. G. Rezkov, J. Struct. Chem., 46, No. 3, 501–507 (2005).
Yu. E. Lozovik and A. M. Popov, Fiz. Tverd. Tela, 44, No. 1, 180–187 (2002).
Y. Xia, Y. Xing, C. Tan, and L. Mei, Phys. Rev., 53, No. 20, 13871–13876 (1996).
C. Kittel, W. Night, and M. Ruderman, Mechanics [Russian translation], Nauka, Moscow (1978).
I. Zhou, Z. Y. Pan, Y. X. Wang, et al., Nanotechnology, 17, 1891–1894 (2006).
J. Lu, S. Nagase, S. Zhang, et al., Phys. Rev., 68, No. 12, 121402(4) (2003).
Z. X. Zhang, Z. Y. Pan, Q. Wei, et al., Int. J. Modern Phys. B, 17, No. 26, 4667–4674 (2003).
V. V. Ivanovskaya, A. N. Enyashin, and A. A. Sofronov, Zh. Obshch. Khim., 74, No. 5, 778–785 (2004).
L. D. Landau and E. M. Livshits, Quantum Mechanics. Nonrelativistic Theory. Theoretical Physics [in Russian], Vol. 3, Nauka, Moscow (1989).
Author information
Authors and Affiliations
Corresponding author
Additional information
__________
Translated from Zhurnal Strukturnoi Khimii, Vol. 48, Supplement, pp. S149–S154, 2007.
Original Russian Text Copyright © 2007 by O. E. Glukhova
Rights and permissions
About this article
Cite this article
Glukhova, O.E. Theoretical study of the structure of the C60@C450 nanoparticle and relative motion of the encapsulated C60 molecule. J Struct Chem 48 (Suppl 1), S141–S146 (2007). https://doi.org/10.1007/s10947-007-0157-y
Received:
Issue Date:
DOI: https://doi.org/10.1007/s10947-007-0157-y