Ab initio insights into the visible luminescent properties of ZnO

Thin Solid Films

Volumn 515, Issue 24 SPEC. ISS., 2007, Pages 8670-8673

  Prades, Joan Daniel ^a   Cirera, Albert ^a   Ramon Morante, Joan ^a   Cornet, Albert ^a  

^a UNIVERSITY OF BARCELONA   (Spain)

Author keywords

Ab initio; DFT; Luminescence; Oxygen vacancy; Surface; ZnO

Indexed keywords

DISCRETE FOURIER TRANSFORMS; ELECTRON TRANSITIONS; LUMINESCENCE; POINT DEFECTS; SURFACE CHEMISTRY; VALENCE BANDS;

OXYGEN VACANCY; SURFACE STATES; SURFACE TRANSITIONS; VISIBLE BANDS;

ZINC OXIDE;

EID: 34648836884     PISSN: 00406090     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.tsf.2007.04.013     Document Type: Article

References (24)

1. Phillips M.R., Gelhausen O., and Goldys E.M. Phys. Status Solidi 201 (2004) 229
2. Özgur Ü., Alivov Ya.I., Liu C., Teke A., Rechchikov M.A., Dogan S., Avrutin V., Cho S.-J., and Markoç H. J. Appl. Phys. 98 (2005) 041301
3. Vanheusden K., Seager C.H., Warren W.L., Tallant D.R., and Voigt J.A. Appl. Phys. Lett. 68 (1996) 403
4. Lin B., Fu Z., and Jia Y. Appl. Phys. Lett. 79 (2001) 943
5. Barces N.Y., Wang L., Bai L., Giles N.C., Halliburton L.E., and Cantwell G. Appl. Phys. Lett. 81 (2002) 943
6. Huang M.H., Wu Y., Feick H., Tran N., Weber E., and Yang P. Adv. Mat. 13 (2001) 113
7. Yao B.D., Chan Y.F., and Wang N. Appl. Phys. Lett. 81 (2002) 757
8. Roy V.A.L., Djuristic A.B., Chan W.K., Gao J., Lui H.F., and Surya C. Appl. Phys. Lett. 83 (2003) 141
9. Hohenberg P., and Kohn W. Phys. Rev. 136 (1964) B864
10. Kohn W., and Sham L.J. Phys. Rev. 140 (1965) A1133
11. Ordejón P., Artacho E., and Soler J.M. Phys. Rev. B 53 (1996) R10441
12. Soler J.M., Artacho E., Gale J.D., García A., Junquera J., Ordejón P., and Sánchez-Portal D. J. Phys., Condens. Matter 14 (2002) 2745
13. Perdew J.P., Burke K., and Ernzerhof M. Phys. Rev. Lett. 77 (1996) 3865
14. Troullier N., and Martins J.L. Phys. Rev. B 43 (1991) 1993
15. J.D. Prades, A. Cirera, J.R. Morante, J.M. Pruneda, P. Ordejón, Sens. Actuators, B, article (in press), doi:10.1016/j.snb.2006.10.040.
16. J.D. Prades, J. Arbiol, A. Cirera, J.R. Morante, M. Avella, L. Zanotti, E. Comini, G. Faglia, G. Sberveglieri, Sens. Actuators, B, article (in press), doi:10.1016/j.snb.2006.10.014.
17. Kohan A.F., Ceder G., Morgan D., and Van de Walle C.G. Phys. Rev. B 61 (2000) 15019
18. Jones R.O., and Gunnarsson O. Rev. Mod. Phys. 61 (1989) 3
19. Reuter K., and Scheffler M. Phys. Rev. B 65 (2002) 035406
20. Göpel W., and Lampe U. Phys. Rev. B 22 (1980) 6447
21. Van de Walle C.G. Physica B 308-310 (2001) 899
22. Erhart P., Albe K., and Klein A. Phys. Rev. B 73 (2006) 205203
23. Leiter F.H., Alves H.R., Hofstaetter A., Hofmann D.M., and Meyer B.K. Phys. Status Solidi 226 (2001) R4
24. Lin B., Fu Z., and Jia Y. Appl. Phys. Lett. 79 (2001) 943