The influence of hydrostatic pressure on the electronic structure and optical properties of tin dioxide: A first-principle study

Physica B: Condensed Matter

Volumn 408, Issue 1, 2013, Pages 73-78

  Cai, Lu Gang ^a   Liu, Fa Min ^a   Zhang, Dian ^a   Zhong, Wen Wu ^a  

^a BEIHANG UNIVERSITY   (China)

Author keywords

Electronic structure; First principles; Optical properties; Tin dioxide

Indexed keywords

COMPLEX DIELECTRIC FUNCTIONS; DIELECTRIC FUNCTIONS; ELECTRONIC STRUCTURE AND OPTICAL PROPERTIES; FIRST PRINCIPLE CALCULATIONS; FIRST-PRINCIPLE STUDY; FIRST-PRINCIPLES; IMAGINARY PARTS; LOSS FUNCTIONS; PHOTON ENERGY; REFLECTIVITY SPECTRA; SECOND-ORDER POLYNOMIAL;

CALCULATIONS; ELECTRONIC STRUCTURE; HYDROSTATIC PRESSURE; TIN; TIN DIOXIDE;

OPTICAL PROPERTIES;

EID: 84870032393     PISSN: 09214526     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.physb.2012.09.038     Document Type: Article

References (22)

1. Y.P. Yadava, G. Denicolo, A.C. Arias, L.S. Roman, and L.A. Hummelgen Mater. Chem. Phys. 48 1997 263
2. E.S. Raj, and K.L. Choy Mater. Chem. Phys. 82 2003 489
3. M. Rami, E. Benamarb, C. Messaoudi, and D. Sayah Solid State Inorg. Chem 35 1998 211
4. H.M. Phillips, Y. Li, Z. Bi, and B. Zhang Appl. Phys. A 63 1996 347
5. R. Dolbec, M.A. El Khakani, A.M. Serventi, and M. Trudeau Thin Solid Films 419 2002 230
6. K. Reimann, and M. Steube Solid State Commun. 105 1998 649
7. P. Barbarat, and S.F. Matar Comput. Mater. Sci. 10 1998 368
8. C.W. Zhang, and S.S. Yan Appl. Phys. Lett. 95 2009 232108
9. J.M.D. Coey, A.P. Douvalis, C.B. Fitzgerald, and M. Venkatesan Appl. Phys. Lett. 84 2004 1332
10. C.M. Liu, X.R. Chen, and G.F. Ji Comput. Mater. Sci. 50 2011 1571
11. M.D. Segall, P.J.D. Lindan, M.J. Probert, and C.J. Pickard J. Phys.: Condens. Matter 14 2002 2717
12. P. Hohenberg, and W. Kohn Phys. Rev. 136 1964 B864
13. W. Kohn, and L.J. Sham Phys. Rev. 140 1965 A1133
14. J.P. Perdew, K. Burke, and M. Ernzerhof Phys. Rev. Lett. 77 1996 3865
15. D.M. Ceperley, and B.J. Alder Phys. Rev. Lett. 45 1980 566
16. J.P. Perdew, and A. Zunger Phys. Rev. B 23 1981 5048
17. D. Vanderbilt Phys. Rev. B 41 1990 7892
18. B.G. Pfrommer, M. Cote, S.G. Louie, and M.L. Cohen J. Comput. Phys. 131 1997 233
19. H.J. Monkhorst, and J.D. Pack Phys. Rev. B 13 1976 5188
20. M. Alouani, and J.M. Wills Phys. Rev. B 54 1996 2487
21. A.A. Bolzan, C. Fong, B.J. Kennedy, and C.J. Howard Acta Crystallogr. Sect. B: Struct. Sci 53 1997 373
22. Y. Li, W. Fan, H. Sun, X. Cheng, and P. Li J. Phys. Chem. A 114 2010 1052