First-principles study on morphology and mechanical properties of single-walled carbon nanotube

作者: Gang Zhou , Wenhui Duan , Binglin Gu

DOI: 10.1016/S0009-2614(00)01404-4

关键词:

摘要: … structure of single-walled carbon nanotube are investigated … The calculated C–C bond length, elastic modulus and tensile … that the bonding between carbon atoms in carbon nanotube is …

参考文章(33)
X. Xu, X. Lü, N.Q. Wang, Q.E. Zhang, Charge-consistency modelling of CO/NiO(100) chemisorption system Chemical Physics Letters. ,vol. 235, pp. 541- 547 ,(1995) , 10.1016/0009-2614(95)00166-2
Teri Wang Odom, Jin-Lin Huang, Philip Kim, Charles M Lieber, None, Atomic structure and electronic properties of single-walled carbon nanotubes Nature. ,vol. 391, pp. 62- 64 ,(1998) , 10.1038/34145
G Dresselhaus, R Saito, M S Dresselhaus, Physical properties of carbon nanotubes ,(1998)
R. S. Mulliken, Electronic Population Analysis on LCAO–MO Molecular Wave Functions. I The Journal of Chemical Physics. ,vol. 23, pp. 1833- 1840 ,(1955) , 10.1063/1.1740588
A. Hassanien, M. Tokumoto, Y. Kumazawa, H. Kataura, Y. Maniwa, S. Suzuki, Y. Achiba, Atomic structure and electronic properties of single-wall carbon nanotubes probed by scanning tunneling microscope at room temperature Applied Physics Letters. ,vol. 73, pp. 3839- 3841 ,(1998) , 10.1063/1.122910
Jing Kong, Nathan R Franklin, Chongwu Zhou, Michael G Chapline, Shu Peng, Kyeongjae Cho, Hongjie Dai, Nanotube molecular wires as chemical sensors Science. ,vol. 287, pp. 622- 625 ,(2000) , 10.1126/SCIENCE.287.5453.622
A. Rubio, Spectroscopic properties and STM images of carbon nanotubes Applied Physics A. ,vol. 68, pp. 275- 282 ,(1999) , 10.1007/S003390050888
C.F. Cornwell, L.T. Wille, Elastic properties of single-walled carbon nanotubes in compression Solid State Communications. ,vol. 101, pp. 555- 558 ,(1997) , 10.1016/S0038-1098(96)00742-9
Y. Song, R. Yang, D. Li, W. T. Wu, Z. X. Guo, Calculation of theoretical strengths and bulk moduli of bcc metals Physical Review B. ,vol. 59, pp. 14220- 14225 ,(1999) , 10.1103/PHYSREVB.59.14220