First-principles study of the perfect and vacancy defect AlN nanoribbon

Physica B: Condensed Matter

Volumn 405, Issue 17, 2010, Pages 3775-3781

  Zheng, Fang Ling ^a   Zhang, Jian Min ^a   Zhang, Yan ^b   Ji, Vincent ^b  

^a SHAANXI NORMAL UNIVERSITY   (China)

^b UNIVERSITÉ PARIS SUD   (France)

Author keywords

AlN nanoribbon; Electronic properties; First principles; Vacancy

Indexed keywords

ALN; BAND GAP WIDTH; DENSITY FUNCTION THEORY; DIRECT BAND GAP; ELECTRONIC AND MAGNETIC PROPERTIES; FIRST-PRINCIPLES; FIRST-PRINCIPLES STUDY; GAP REGIONS; GENERALIZED GRADIENT APPROXIMATIONS; INDIRECT BAND GAP; N VACANCY; NANORIBBONS; NONMAGNETICS; PROJECTOR-AUGMENTED WAVES; SEMI-METALS; SPIN POLARIZED TRANSPORT; VACANCY DEFECTS; ZIGZAG EDGES;

ALUMINUM; DEFECT DENSITY; DEFECTS; ELECTRONIC PROPERTIES; ENERGY GAP; MAGNETIC MATERIALS; MAGNETIC MOMENTS; MAGNETIC PROPERTIES; SPIN DYNAMICS;

VACANCIES;

EID: 77955550383     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2010.05.085     Document Type: Article

References (32)

1. M. Farahani, T.S. Ahmadi, and A. Seif J. Mol. Struct. 913 2009 126
2. H.T. Cong, H.B. Ma, and X.C. Sun Physica B 323 2002 354
3. B.K. Agrawal, A. Pathak, and S. Agrawal J. Nanopart. Res. 11 2009 841
4. L. Baird, G.H. Ang, C.H. Low, N.M. Haegel, A.A. Talin, Q.M. Li, and G.T. Wang Physica B 404 2009 4933
5. S. Azadi, and R. Moradian Phys. Lett. A 374 2010 605
6. K. Rezouali, M.A. Belkhir, A. Houari, and J.B. Bai Comput. Mater. Sci. 45 2009 305
7. K. Nakada, and M. Fujita Phys. Rev. B 54 1996 17954
8. K.S. Novoselov, A.K. Geim, S.V. Morozov, D. Jiang, Y. Zhang, S.V. Dubonos, I.V. Grigorieva, and A.A. Filrsov Science 306 2004 666
9. Y. Zhang, Y.W. Tan, H.L. Stormer, and P. Kim Nature 438 2005 201
10. Y. Miyamoto, K. Nakada, and M. Fujita Phys. Rev. B 59 1999 9858
11. Y.W. Son, M.L. Cohen, and S.G. Louie Phys. Rev. Lett. 97 2006 216803
12. Y. Zhang, Y.W. Tan, H.L. Stormer, and P. Kim Nature 438 2005 201
13. E.J. Kan, Z.Y. Li, J.L. Yang, and J.G. Hou Appl. Phys. Lett. 91 2007 243116
14. L. Pisani, J.A. Chan, B. Montanari, and N.M. Harrison Phys. Rev. B 75 2007 064418
15. S. Cahangirov, M. Topsakal, E. Aktrk, H. Sahin, and S. Ciraci Phys. Rev. Lett. 102 2009 236804
16. L. Sun, Y.F. Li, Z.Y. Li, Z. Zhou, and Z.F. Chen J. Chem. Phys. 129 2008 174114
17. A.R. Botello-Mndez, M.T. Martnez-Martnez, F. Lpez-Uras, M. Terrones, and H. Terrones Chem. Phys. Lett. 448 2007 258
18. Y.F. Li, Z. Zhou, S.B. Zhang, and Z.F. Chen J. Am. Chem. Soc. 130 2008 16739
19. T. Xie, Y. Lin, G.S. Wu, X.Y. Yuan, Z. Jiang, C.H. Ye, G.W. Meng, and L.D. Zhang Inorg. Chem. Commun. 7 2004 545
20. A.N. Andriotis, R.M. Sheetz, and M. Menon Phys. Rev. B 74 2006 153403
21. G. Kresse, and J. Hafner Phys. Rev. B 47 1993 558
22. G. Kresse, and J. Hafner Phys. Rev. B 49 1994 14251
23. G. Kresse, and J. Furthmller Comput. Mater. Sci. 6 1996 15
24. G. Kresse, and J. Furthmller Phys. Rev. B 54 1996 11169
25. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5390
26. W. Kohn, and L. Sham Phys. Rev. A 140 1965 1133
27. G. Kresse, and D. Joubert Phys. Rev. B 59 1999 1758
28. J.P. Perdew, S. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
29. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
30. A.J. Du, S.C. Smith, and G.Q. Lu Chem. Phys. Lett. 447 2007 181
31. M. Topsakal, E. Aktrk, and S. Ciraci Phys. Rev. B 79 2009 115442
32. G. Kim, B.W. Jeong, and J. Ihm Appl. Phys. Lett. 88 2006 193107