Structural and Electronic Properties of Zno nanoclusters: a b3lyp dft study

Advanced Materials Research Vol. 650
33

---

Advances in Materials Science and Engineering
10.4028/www.scientific.net/AMR.650
Structural and Electronic Properties of ZnO NANOCLUSTERs: A B3LYP DFT Study
10.4028/www.scientific.net/AMR.650.29
 
 
DOI References
[5] L.M. Kukreja, A. Rohlfing, P. Misra, F. Hillenkamp and K. Dreisewerd: Appl. Phys. A: Mater. Sci.
Process Vol. 78 (2004), pp.641-644.
http://dx.doi.org/10.1007/s00339-003-2272-8
 
[6] A. Dmitruk, I. Dmitruk, I. Blonsky, R. Belosludov, Y. Kawazoe and A. Kasuya: Microele. Jour. Vol. 40
(2009), p.218–220.
http://dx.doi.org/10.1016/j.mejo.2008.07.010
 
[7] I. Ozerov, D. Nelson, A.V. Bulgakov, W. Marine and M. Sentis: Appl. Surf. Sci. Vol. 212 (2003), pp.349-
352.
http://dx.doi.org/10.1016/S0169-4332(03)00100-4
 
[9] S. Acquaviva, E. D'Anna and M.L. De Giorgi: J. Appl. Phys. Vol. 102 (2007), p.073109.
http://dx.doi.org/10.1063/1.2786711
 
[10] J. Chen, Z. Feng, P. Ying and C. Li: J. Phys. Chem. B Vol. 108 (2004), pp.12669-12676.
http://dx.doi.org/10.1021/jp048746x
[12] I. Muntele, C. Muntele, P. Thevenard and D. Ila: Surf. Coating Technol. Vol. 201 (2007), pp.8557-8559.
http://dx.doi.org/10.1016/j.surfcoat.2006.01.086
 
[13] S. Wu, N. Yuan, H. Xu, X. Wang and Z.A. Schelly: Nanotechnology Vol. 17 (2006), pp.4713-4718.
http://dx.doi.org/10.1088/0957-4484/17/18/031
[14] J.M. Matxain, J.M. Mercero, J.E. Fowler and J.M. Ugalde: J. Am. Chem. Soc. Vol. 125 (2003), p.9494.
http://dx.doi.org/10.1021/ja0264504
[16] E.C. Behrman, R.K. Foehrweiser, J.R. Myers, B.R. French and M.E. Zandler: Phys. Rev. A Vol. 49
(1994), pp.1543-1546.
http://dx.doi.org/10.1103/PhysRevA.49.R1543
 
[17] M.E. Zandler, E.C. Behrman, M.B. Arrasmith, J.R. Myers and T.V. Smith: J. Mol. Struct. Vol. 362
(1996), pp.215-224.
http://dx.doi.org/10.1016/0166-1280(95)04411-6
[19] A. Jain, V. Kumar and Y. Kawazoe: Comput. Mater. Sci. Vol. 36 (2006), pp.258-262.
http://dx.doi.org/10.1016/j.commatsci.2005.06.008
[21] B. Wang, S. Nagas, J. Zhao and G. Wang: J. Phys. Chem. C Vol. 111(2007), pp.4956-4963.
http://dx.doi.org/10.1021/jp066548v
[22] B. Wang, X. Wang, G. Chen, S. Nagase and J. Zhao: J. Chem. Phys. Vol. 128 (2008), p.144710.
http://dx.doi.org/10.1063/1.2898882
 
[23] P.S. Yadav, D.K. Pandey, S. Agrawal and B.K. Agrawal: J. Nanopart. Res Vol. 12 (2010), pp.737-757.
http://dx.doi.org/10.1007/s11051-010-9861-1