Long-range order effects in Pb(Zr1/2Ti1/2)O3

Ferroelectrics

Volumn 194, Issue 1-4, 1997, Pages 287-298

  Sághi Szabó, Gotthard ^b   Cohen, Ronald E ^a  

^a GEOPHYSICAL LABORATORY   (United States)

^b NONE

Author keywords

Ferroelectric; LAPW + LO; LDA; Long range order; PZT; Superlattice, PIB

Indexed keywords

FERROELECTRIC MATERIALS; ORDER DISORDER TRANSITIONS; SUPERLATTICES; CALCULATIONS; CRYSTAL DEFECTS; LEAD COMPOUNDS; OXIDES; TITANIUM COMPOUNDS; ZIRCONIUM COMPOUNDS;

LINEARIZED AUGMENTED PLANEWAVE (LAPW); PZT;

LEAD COMPOUNDS; FERROELECTRIC MATERIALS;

EID: 0030609275     PISSN: 00150193     EISSN: None     Source Type: Journal    
DOI: 10.1080/00150199708016100     Document Type: Article

References (36)

1. Masuda, A., Yamanaka, Y., Tazoe, M., Yonezawa, Y., Morimoto, A and Shimizu. T. (1995). Jpn. J. Appl. Phys., 34, 5154.
2. Akoi, K., Fukuda, Y., Numata, K and Nishimura, A. (1995). J. Appl. Phys., 34, 746.
3. Sotome, Y., Senzaki, J , Morita, S., Tanimoto, S. Hirai, T., Ueno, T., Kuroiwa, K. and Tanimoto, S. (1994). Jpn. J. Appl. Phys., 33, 4066.
4. Jaffe, B., Cook, W. F. and Jaffe, F., Piezoelectric Ceramics, (Academic Press, London, 1971).
5. Glazer, A. M., Roleder, K. and Dec, J. (1993). Acta Cryst. B, 49, 846.
6. Whatmore, R. W. and Glazer, A. M. (1979). J. Phys. C, 12, 1505.
7. Randall, C. A., Matsko, M. G., Cao, W. and Bhalla, A. S. (1977). Solid State Commun., 24, 769.
8. Cao, W. and Cross, L. E. (1993). Phys. Rev. B, 47, 4825.
9. Ari-Gur, P. and Benguigui, L. (1974). Solid State Commun., 15, 1077.
10. Landau, L. D. and Lifshitz, E. M. Statistical Physics, (Pergamon Press 1959).
11. Kakegawa, K., Mohri, J., Shirasaki, S. and Takahashi, K. (1982). J. Am. Ceram. Soc., 65, 515.
12. Viehland, D. (1995). Phys. Rev. B, 52, 778.
13. Cohen, R. E. and Krakauer, H. (1990). Phys. Rev. B, 42, 6416.
14. Cohen, R. E. and Krakauer, H. (1992). Ferroelectrics, 136, 65.
15. King-Smith, R. D. and Vanderbilt, D. (1994). Phys. Rev. B, 49, 5828.
16. Singh, D. J. and Boyer, L. L. (1992). Ferroelectrics, 136, 95.
17. Singh, D. J. (1995). Ferroelectrics, 164, 143.
18. Singh, D. J. (1995). Phys. Rev. B, 52, 12559.
19. Singh, D. J. (1996). Phys. Rev. B, 53, 176.
20. Wang, C. -Z., Yu, R. and Krakauer, H. (1994). Phys. Rev. Letters., 72, 368.
21. Yu, R. and Krakauer, H. (1994). Phys. Rev. B, 49, 4467.
22. Singh, D. J. Planewaves, Pseudopotentials and the LAPW Method , (Kluwer Academic Publishers, Boston, 1994).
23. Mehl, M. J., Hemley, R. J. and Boyer, L. L. (1986). Phys. Rev. B, 33, 8685.
24. Cohen, R. E., Boyer, L. L. and Mehl, M. J. (1987). Phys. Rev. B, 35, 5749.
25. Burton, B. P. and Cohen, R. E. (1995). Phys. Rev. B, 52, 792.
26. Hedin, L. and Lundquist, B.I. (1971). J. phys. C, 4, 2064.
27. Baldereschi, A. (1973). Phys. Rev. B, 7, 5212.
28. Chadi, D. J. and Cohen, M. L. (1973). Phys. Rev. B, 8, 5747.
29. Monkhorst, H. J. and Pack, J. D. (1976). Phys. Rev. B, 13, 5188.
30. Monkhorst, H. J. and Pack, J. D. (1977). Phys. Rev. B, 16, 1748.
31. Gordon, R. G. and Kim, Y. S. (1972). J. Chem. Phys., 56, 3122.
32. Watson, R. E. (1958). Phys. Rev., 111, 1108.
33. Kohn, W. and Sham, L. J. (1965). Phys. Rev., 140, A1133.
34. Vinet, P., Ferrante, J., Rose, J. H. and Smith, J. R. (1987). J. Geophys. Res., 92, 9319.
35. Murnaghan, F. D. Finite Deformation of an Elastic Solid (John Wiley, New York, 1951).
36. Hirai, T., Teramoto, K., Goto, T. and Tarui, Y. (1995). Jpn. J. Appl. Phys., 34, 539.