The effect of B site cations on optical properties of paraelectric KTa1/2Nb1/2O3 crystal

Computational Materials Science

Volumn 41, Issue 4, 2008, Pages 542-546

  Shen, Yanqing ^a   Zhou, Zhongxiang ^a  

^a HARBIN INSTITUTE OF TECHNOLOGY   (China)

Author keywords

Density functional theory; Extinction coefficient; KTa1 2Nb1 2O3; Optical conductivity; Reflectivity; Refractive index

Indexed keywords

DENSITY FUNCTIONAL THEORY; OPTICAL CONDUCTIVITY; PARAMETER ESTIMATION; POSITIVE IONS; REFLECTION; REFRACTIVE INDEX;

EXTINCTION COEFFICIENT; PARAELECTRIC SOLID SOLUTION;

CRYSTAL LATTICES;

EID: 38649106094     PISSN: 09270256     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.commatsci.2007.05.020     Document Type: Article

References (18)

1. Hofmeister R., Yariv A., Yagi S., and Agranat A.J. Phys. Rev. Lett. 69 (1992) 1459-1462
2. Pattnaik R., and Toulouse J. Phys. Rev. Lett. 79 (1997) 4677-4680
3. Knauss L.A., Harshavardhan K.S., Christen H.-M., Zhang H.Y., He X.H., Shih Y.H., Grabowski K.S., and Knies D.L. Appl. Phys. Lett. 73 (1998) 3806-3808
4. Ishai P.B., de Oliveira C.E.M., Ryabov Y., Feldman Y., and Agranat A.J. Phys. Rev. B 70 (2004) 132104-1-132104-4
5. Rankel S., Zalar B., Laguta V.V., Blinc R., and Toulouse J. Phys. Rev. B 71 (2005) 144110-1-144110-5
6. B Ishai P., Agranat A.J., and Feldman Y. Phys. Rev. B 73 (2006) 104104-1-104104-7
7. Wang X., Wang J., Yu Y., Zhang H., and Boughton R.I. J. Cryst. Growth 293 (2006) 398-403
8. Eglitis R.I., Kotomin E.A., and Borstel G. Solid State Commun. 108 (1998) 333-336
9. Eglitis R.I., Kotomin E.A., and Borstel G. Comput. Mater. Sci. 21 (2001) 530-534
10. Eglitis R.I., Fuks D., Dorfman S., Kotomin E.A., and Borstel G. Mater. Sci. Semicond. Proc. 5 (2003) 153-157
11. Sepliarsky M., Phillpot S.R., Wolf D., Stachiotti M.G., and Migoni R.L. Appl. Phys. Lett. 76 (2000) 3986-3988
12. Peng Y.P., Wang Y.X., Zhang L., Wang C.L., Zhang P.L., and Zhong W.L. Phys. Lett. A 269 (2000) 170-174
13. Wang Y.X., Zhong W.L., Wang C.L., and Zhang P.L. Phys. Lett. A 285 (2001) 390-394
14. Wang Y.X., Zhong W.L., Wang C.L., Zhang P.L., and Tao S.X. Chinese Phys. 11 (2002) 714-719
15. Wang Y.X., Zhong W.L., Wang C.L., and Zhang P.L. Opt. Commun. 201 (2002) 79-84
16. Hohenberg P., and Kohn W. Phys. Rev. 136 (1964) B864-B871
17. Kohn W., and Sham L.J. Phys. Rev. 140 (1965) A1133-A1138
18. Segall M.D., Lindan P.J.D., Probert M.J., Pickard C.J., Hasnip P.J., Clark S.J., and Payne M.C. J. Phys.: Condens. Mat. 14 (2002) 2717-2744