First-principles structural stability in the strontium-titanium-oxygen system

Philosophical Magazine

Volumn 86, Issue 15, 2006, Pages 2283-2292

  Le Bacq, O ^a   Salinas, E ^a   Pisch, A ^a   Bernard, C ^a   Pasturel, A ^b  

^a CNRS   (France)

^b UNIVERSITÉ JOSEPH FOURIER   (France)

Author keywords

[No Author keywords available]

Indexed keywords

CONSTRAINT THEORY; DEFORMATION; INTERCALATION COMPOUNDS; PEROVSKITE; ROTATION; STABILITY; STRAIN; STRUCTURAL ANALYSIS; TITANIUM COMPOUNDS;

OCTAHEDRONS; PEROVSKITE STRUCTURE; STRUCTURAL STABILITY;

STRONTIUM COMPOUNDS;

EID: 33646520177     PISSN: 14786435     EISSN: 14786443     Source Type: Journal    
DOI: 10.1080/14786430500509047     Document Type: Conference Paper

References (37)

1. M. Cardona, Phys. Rev. A 140 651 (1965).
2. V.E. Henrich, Rep. Prog. Phys. 48 1481 (1985).
3. J.G. Bednorz and K.A. Muller. Phys. Rev. Lett. 52 2289 (1984).
4. F. Gervais, B. Claes and P. Odier, Mater. Res. Bull. 22 1629 (1987).
5. H.P.R. Frederikse, W.R. Thurber and W.R. Hosler, Phys. Rev. A 134 442 (1964).
6. U. Balachandran and N.G. Error, J. Solid St. Chem. 39 351 (1981).
7. U. Balachandran and N.G. Error, J. Electrochem. Soc. 129 1021 (1982).
8. B. Odekirk, U. Balachandran, N.G. Error, et al., Mater. Res. Bull. 17 199 (1982).
9. K.H. Kirn, K.H. Yoon and J.S. Choi, J. Phys. Chem. Solids 46 1061 (1985).
10. J.F. Schooley, W.R. Hosler and M.L. Cohen, Phys. Rev. Lett. 12 474 (1964).
11. J.F. Schooley, W.R. Hosler, E. Amber, et al., Phys. Rev. Lett. 14 305 (1965).
12. C.S. Koonce, M.L. Cohen. J.F. Schooley, et al., Phys. Rev. 163 380 (1967).
13. M. Ziese, Rep. Prog. Phys. 65 143 (2002).
14. H. Dulli, E.W. Plummer, P.A. Dowben, et al., Appl. Phys. Lett. 77 570 (2000).
15. C.N. Borca, B. Xu, T. Komesu, et al., Surf. Sci. Lett. 512 346 (2002).
16. Y. Lu, X.W. Lee, G.O. Gong, et al., Phys. Rev. B 54 8357 (1996).
17. T. Obata, T. Manako, Y. Shimakawa, et al., Appl. Phys. Lett. 74 290 (1999).
18. J.M. De Teresa, A. Barthelemy, A. Fert, et al., Science 286 507 (1999).
19. F. He, B.O. Wells, Z-G. Ban, et al., Phys. Rev. B 70 235405 (2004).
20. S.N. Ruddlesden and P. Popper, Acta Crystallogr. 11 54 (1958).
21. K.R. Udayakumar and A.N. Cormack, J. Am. Ceram. Soc. 71 C-469 (1988).
22. K.R. Udayakumar and A.N. Cormack, J. Phys. Chem. Solids 50 55 (1989).
23. R.J.D. Tilley, J. Solid St. Chem. 21 293 (1977).
24. M.A. McCoy, R.W. Grimes and W.E. Lee, Phil. Mag. A 75 833 (1997).
25. T. Suzuki and M. Fujimoto, J. Appl. Phys. 89 5622 (2001).
26. C. Noguera, Phil. Mag. Lett. 80 173 (2000).
27. G. Kresse and J. Furthmüller. Comput. Mater. Sci. 6 15 (1996).
28. G. Kresse and J. Furthmüller, Phys. Rev. B 54 11169 (1996).
29. G. Kresse and D. Joubert, Phys. Rev. B 59 1758 (1999).
30. J.P. Perdew and Y. Wang, Phys. Rev. B 45 13244 (1992).
31. A. Ahtee, M. Ahtee, A.M. Glazer, et al., Acta. Crystailogr. B 32 3243 (1976).
32. J.A.M. van Roosmalen, P. van Viaanderen and E.H.P. Cordfunke, J. Solid St. Chem. 101 59 (1992).
33. R.J. Angel, J. Zhao and N.L. Ross, Phys. Rev. Lett. 95 25503 (2005).
34. G. Fabricius, E.L. Peltzer y Blanca, C.O. Rodriguez, et al., Phys. Rev, B 55 164 (1997).
35. S-Di, Mo, W.Y. Ching, M.F. Chisholm, et al., Phys. Rev. B 60 2416 (1999).
36. I.N. Yakovin and M. Gutowski, Phys. Rev. B 70 165319 (2004).
37. D.R. Lide, CRC Handbook of Chemistry and Physics, 72nd ed. (CRC Press, Boston, 1991).