Abstract
Recent advances in the fabrication and characterization of semiconductor and metallic nanowires are proving very successful in meeting the high expectations of nanotechnologists. Although the nanoscience surrounding sp3 bonded carbon nanotubes has continued to flourish over recent years the successful synthesis of the sp3 analogue, diamond nanowires, has been limited. This prompts questions as to whether diamond nanowires are fundamentally unstable. By applying knowledge obtained from examining the structural transformations in nanodiamond, a framework for analyzing the structure and stability of diamond nanowires may be established. One possible framework will be discussed here, supported by results of ab initio density functional theory calculations used to study the structural relaxation of nanodiamond and diamond nanowires. The results show that the structural stability and electronic properties of diamond nanowires are dependent on the surface morphology, crystallographic direction of the principal axis, and the degree of surface hydrogenation.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
Preview
Unable to display preview. Download preview PDF.
References
O.A. Shenderova, V.V. Zhimov, and D.W. Brenner. Carbon Nanostructures. Critical Reviews in Solid State and Material Sciences 27, 227 (2002).
Y. Gogotsi Perspective, Designing Carbon Crystals for Nanotechnology Applications. Crystal Growth & Design 1, 179 (2001).
N.R. Greiner, D.S. Phillips, J.D. Johnson, and F. Volk. Diamonds in detonation soot. Nature 333, 440 (1998).
D.M. Gruen. Nanocrystalline diamond films. Annual Reviews of Material Science 29, 211 (1999).
T. Sharda and T. Soga. A different regime of nanostructured diamond film growth. Journal of Nanoscience and Nanotechnology 3, 521 (2003).
T. Wang, H.W. Xin, Z.M. Zhang, Y.B. Dai, H.S. Shen. The fabrication of nanocrystalline diamond films using hot filament CVD. Diamond and Related Materials 13, 6 (2004).
V.L. Kuznetsov, A.L. Chuvilin, Y.V. Butenko, I.Y. Mal’kov, and V.M. Titov. Onion-Like carbon From ultra-disperse diamond. Chemical Physics Letters 222, 343 (1994).
V.L. Kuznetsov, I.L. Zilberberg, Y.V. Butenko, A.L. Chuvilin, and B. Seagall, Theoretical study of the formation of closed curved graphite-like structures during annealing of diamond surface. Journal of Applied Physics 86, 863 (1999).
F. Banhart and P.M. Ajayan. Carbon onions as nanoscopic pressure cells for diamond formation. Nature 382, 433 (1996).
M. Zaiser and F. Banhart. Radiation-induced transformation of graphite to diamond. Physical Review Letters 79, 3680 (1997).
F. Banhart. The transformation of graphitic onions to diamond under electron irradiation. Journal of Applied Physics 81, 3440 (1997).
E.-S. Baik, Y.-J. Baik, and D. Jeon. Aligned diamond nanowhiskers. Journal of Materials Research 15, 923 (2000).
H. Masuda, T. Yanagishita, K. Yasui, K. Nishio, I. Yagi, T.N. Rao, and A. Fujishima. Synthesis of well-aligned diamond nanocylinders. Advanced Materials 13, 247 (2001).
Y. Ando, Y. Nishibayaski, and A. Sawabe. ‘Nano-rods’ of single crystalline diamond. Diamond and Related Materials 13, 366 (2004).
A.S. Barnard, S.P. Russo, and I.K. Snook. Ab initio modelling of diamond nanowire structures. Nano Letters 3, 1323 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. Surface Structure of Cubic Diamond Nanowires. Surface Science 538, 204 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. From nanodiamond to diamond nanowires. Structural properties affected by dimension. Philosophical Magazine 84, 899 (2004).
A.S. Barnard, S.P. Russo, and I.K. Snook. Bucky-wires and the instability of diamond (111) surfaces in one-dimension. Journal of Nanoscience and Nanotechnology 4, 151 (2004).
J. Perdew and Y. Wang. Accurate and simple analytic representation of the electrongas correlation-energy. Physical Review B 45, 13244 (1992).
G. Kresse and J. Hafner. Ab initio molecular dynamics for liquid metals. Physical Review B 47, RC558 (1993).
G. Kresse and J. Furthmüller. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Physical Review B 54, 11169 (1996).
G. Kresse and J. Furthmüller. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set Computational Materials Science 6, 15 (1996).
D.M. Wood and A. Zunger. A new method for diagonalising large matrices. Journal of Physics A 18, 1343 (1985).
D. Vanderbilt. Soft self-consistent pseudopotentials in a generalized eigenvalue formalism. Physical Review B 41, 7892 (1990).
G. Kresse and J. Hafner. Norm-conserving and ultrasoft pseudopotentials for first-row and transition-elements. Journal of Physics Condensed Matter 6, 8245 (1994).
N.W. Winter and F.H. Ree Kinetics and thermodynamic behavior of carbon clusters under high pressure and high temperature. Journal of Computer-Aided Materials Design 5, 279 (1998).
F. Fugaciu, H. Hermann, and G. Seifert. Concentric-shell fullerenes and diamond particles, A molecular-dynamics study. Physical Review B 60, 10711 (1999).
J.Y. Raty, G. Galli, C. Bostedt, T.W. Buuren, and L.J. Terminello. Quantum confinement and fullerenelike surface reconstructions in nanodiamonds. Physical Review Letters 90, 37402 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. Ab initio modelling of stability of nanodiamond morphologies. Philosophical Magazine Letters 83,39 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. Structural relaxation and relative stability of nanodiamond morphologies. Diamond and Related Materials 12, 1867 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. First principles investigations of diamond ultrananocrystals. International Journal of Modern Physics B 17, 3865 (2003).
S.P. Russo, A.S. Barnard, and I.K. Snook. Hydrogenation of nanodiamond surfaces, Structure and effects on crystalline stability. Surface Review and Letters 10,233 (2003).
A.S. Barnard, S.P. Russo, and I.K. Snook. Coexistence of bucky diamond with the nanodiamond and fullerene carbon phases. Physical Review B 68, 73406 (2003).
J. Furthmüller, J. Hafner, and G. Kresse. Dimer reconstruction and electronic surface states on clean and hydrogenated diamond (100) surfaces. Physical Review B 53, 7334 (1996).
Barnard A.S., N.A. Marks, S.P. Russo, and I.K. Snook. Hydrogen stabilization of 111 nanodiamond. Materials Research Society Symposium Proceedings 740, 69 (2003).
J.Y. Raty and G. Galli. Ultradispersity of diamond at the nanoscale. Nature Materials 2, 792 (2003).
Y. K. Chang, H.H. Hsieh, W.F. Pong, M.-H. Tsai, F.Z. Chien, P.K. Tseng, L.C. Chen, T.Y. Wang, K.H. Chen, D.M. Bhusari, J.R. Yang, and S.T. Lin. Quantum confinement effect in diamond nanocrystals studied by X-ray-absorption spectroscopy. Physical Review Letters 82, 5377 (1999).
A.S. Barnard, S.P. Russo, and I.K. Snook. Electronic band gaps of diamond nanowires. Physical Review B 68, 235407 (2003).
G. Kern and J. Hafner. Ab initio calculations of the atomic and electronic structure of clean and hydrogenated diamond (110) surfaces. Physical Review B 56, 4203 (1997).
Author information
Authors and Affiliations
Editor information
Editors and Affiliations
Rights and permissions
Copyright information
© 2005 U.S. Government
About this paper
Cite this paper
Barnard, A. (2005). From Nanodiamond to Nanowires. In: Gruen, D.M., Shenderova, O.A., Vul’, A.Y. (eds) Synthesis, Properties and Applications of Ultrananocrystalline Diamond. NATO Science Series, vol 192. Springer, Dordrecht. https://doi.org/10.1007/1-4020-3322-2_3
Download citation
DOI: https://doi.org/10.1007/1-4020-3322-2_3
Publisher Name: Springer, Dordrecht
Print ISBN: 978-1-4020-3320-9
Online ISBN: 978-1-4020-3322-3
eBook Packages: Physics and AstronomyPhysics and Astronomy (R0)