Possible origin of ferromagnetism in un-doped ZnO: First-principles calculations

Physics Letters, Section A: General, Atomic and Solid State Physics

Volumn 375, Issue 3, 2011, Pages 638-641

  Lin, Xue Ling ^a   Yan, Shi Shen ^a   Zhao, Ming Wen ^a   Hu, Shu Jun ^a   Han, Chong ^a   Chen, Yan Xue ^a   Liu, Guo Lei ^a   Dai, You Yong ^a   Mei, Liang Mo ^a  

^a SHANDONG UNIVERSITY   (China)

Author keywords

Ferromagnetism; First principles calculations; ZnO

Indexed keywords

ELECTRONIC STRUCTURE; FERROMAGNETISM; II-VI SEMICONDUCTORS; MAGNETIC MOMENTS; ZINC OXIDE; ZINC SULFIDE;

DOPED ZNO; FIRST-PRINCIPLES CALCULATION; INTRINSIC DEFECTS; WURTZITE ZNO; ZN VACANCIES;

CALCULATIONS;

EID: 78650877446     PISSN: 03759601     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physleta.2010.11.016     Document Type: Article

References (21)

1. M. Venkatesan, C.B. Fitzgerald, and J.M.D. Coey Nature (London) 430 2004 630
2. G. Rahman, V.M. García-Suárez, and S.C. Hong Phys. Rev. B 78 2008 184404
3. H.W. Peng, J.B. Li, S.S. Li, and J.B. Xia Phys. Rev. B 79 2009 092411
4. S.Q. Zhou, E. Čižmár, K. Potzger, M. Krause, G. Talut, M. Helm, J. Fassbender, S.A. Zvyagin, J. Wosnitza, and H. Schmidt Phys. Rev. B 79 2009 113201
5. J.F. Hu, Z.L. Zhang, M. Zhao, H.W. Qin, and M.H. Jiang Appl. Phys. Lett. 93 2008 192503
6. S. Banerjee, M. Mandal, N. Gayathri, and M. Sardar Appl. Phys. Lett. 91 2007 182501
7. Q.Y. Xu, H. Schmidt, S.Q. Zhou, K. Potzger, M. Helm, H. Hochmuth, M. Lorenz, A. Setzer, P. Esquinazi, C. Meinecke, and M. Grundmann Appl. Phys. Lett. 92 2008 082508
8. X. Zuo, S.D. Yoon, A. Yang, W.H. Duan, C. Vittoria, and V.G. Harris J. Appl. Phys. 105 2009 07C508
9. Z.J. Yan, Y.W. Ma, D.L. Wang, J.H. Wang, Z.S. Gao, L. Wang, P. Yu, and T. Song Appl. Phys. Lett. 92 2008 081911
10. K.S. Yang, R.Q. Wu, L. Shen, Y.P. Feng, Y. Dai, and B.B. Huang Phys. Rev. B 81 2010 125211
11. H.W. Peng, H.J. Xiang, S.H. Wei, S.S. Li, J.B. Xia, and J.B. Li Phys. Rev. Lett. 102 2009 017201
12. J.A. Chan, S. Lany, and A. Zunger Phys. Rev. Lett. 103 2009 016404
13. P. Dev, Y. Xue, and P.H. Zhang Phys. Rev. Lett. 100 2008 117204
14. P. Erhart, K. Albe, and A. Klein Phys. Rev. B 73 2006 205203
15. A. Janotti, and C.G. Van de Walle Phys. Rev. B 76 2007 165202
16. F. Tuomisto, V. Ranki, K. Saarinen, and D.C. Look Phys. Rev. Lett. 91 2003 205502
17. A. Zubiaga, F. Plazaola, J.A. García, F. Tuomisto, V. Muñoz-Sanjosé, and R. Tena-Zaera Phys. Rev. B 76 2007 085202
18. P. Giannozzi http://www.quantum-espresso.org/
19. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
20. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
21. H. Liu, X. Zhang, L.Y. Li, Y.X. Wang, K.H. Gao, Z.Q. Li, R.K. Zheng, S.P. Ringer, B. Zhang, and X.X. Zhang Appl. Phys. Lett. 91 2007 072511