Phonon spectrum of (formula presented) spinel from inelastic neutron scattering and first-principles calculations

Physical Review B - Condensed Matter and Materials Physics

Volumn 66, Issue 14, 2002, Pages 1-7

  Fang, C M ^a   Loong, C K ^b   De Wijs, G A ^c   De With, G ^a  

^a EINDHOVEN UNIVERSITY OF TECHNOLOGY   (Netherlands)

^b ARGONNE NATIONAL LABORATORY   (United States)

^c Faculty of Sciences   (Netherlands)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 84872790719     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.66.144301     Document Type: Article

References (45)

1. N. W. Wyckoff, Crystal Structures (Interscience, NY, 1962), Vol. 2.
2. K. E. Sickafus and R. Hughes, J. Am. Ceram. Soc. 82, 3277 (1999).
3. E. G. Ravenstein, Nature (London) 44, 423 (1891).
4. N. W. Grimes, Phys. Technol. 6, 22 (1975).
5. H. St. C. O’Neill and W. A. Dollase, Phys. Chem. Miner. 20, 541 (1994).
6. N. Kashii, H. Maekawa, and Y. Hinatsu, J. Am. Ceram. Soc. 82, 1844 (1999).
7. S. Lucchesi, A. Della Giusta, and U. Russo, Miner. Mag. 62, 41 (1998).
8. I. Futoshi, G. Naoyuki, and M. Masashi, U.S. Patent No. 5,561,089 (1 October 1996).
9. J. Wrzyszcz, M. Zawadzki, J. Trawczynski, H. Grabowska, and W. Mista, Appl. Catal., A 210, 263 (2001).
10. J. C. J. Bart and R. P. A. Sneeden, Catal. Today 2, 1 (1987).
11. M. A. Valenzuela, G. Anguilar, P. Bosch, H. Armendariz, P. Salas, and A. Montoya, Catal. Lett. 15, 179 (1992).
12. R. Roesky, J. Weigury, H. Bestgen, and U. Dingerdissen, Appl. Catal., A 176, 213 (1999).
13. H. Matsui, C.-N. Xu, and H. Tateyama, Appl. Phys. Lett. 78, 1068 (2001).
14. W. Strek, P. Deren, A. Bednarkiewicz, M. Zawadzki, and J. Wryzyszcz, J. Alloys Compd. 300-301, 456 (2000).
15. International Tables for Crystallography, edited by T. Hahn (Reidel, Dordrecht, 1983), Vol. A.
16. W. H. Bragg, Philos. Mag. 30, 305 (1915).
17. S. Nishikawa, Proc. Tokyo Math.-Phys. Soc. 8, 199 (1915).
18. A. Chopelas and A. M. Hofmeister, Phys. Chem. Miner. 18, 279 (1991).
19. Infrared Spectra of Minerals and Related Inorganic Compounds, edited by J. A. Gadsden (Acford, Chichester, Sussex, 1975).
20. S. Hafner, Z. Kristallogr. 115, 331 (1961).
21. R. Brunel and R. Vierne, Bull. Soc. Fr. Mineral. Cristallogr. 93, 328 (1970).
22. L. J. Alvarez, P. Bosch, and M. A. Valenzuela, Catal. Lett. 22, 361 (1993).
23. C.-K. Loong, P. Vashishta, P. K. Kaila, W. Jin, M. H. Degani, D. G. Hinks, D. L. Price, J. D. Jorgensen, B. Dabrowski, A. W. Mitchell, D. R. Richards, and Y. Zheng, Phys. Rev. B 45, 5052 (1992).
24. G. A. de Wijs, C. M. Fang, G. Kresse, and G. de With, Phys. Rev. B 65, 094305 (2002).
25. C.-K. Loong, S. Ikeda, and J. M. Carpenter, Nucl. Instrum. Methods Phys. Res. A 260, 381 (1987).
26. G. Kresse and J. Hafner, Phys. Rev. B 47, 558 (1993);
27. Phys. Rev. BG. Kresse, J. Hafner49, 14251 (1994).
28. G. Kresse and J. Furthmueller, Comput. Mater. Sci. 6, 15 (1996).
29. G. Kresse and J. Furthmueller, Phys. Rev. B 54, 11 169 (1996).
30. G. Kresse, J. Furthmueller, and J. Hafner, Europhys. Lett. 32, 729 (1995).
31. G. Kern, G. Kresse, and J. Hafner, Phys. Rev. B 59, 8551 (1999).
32. K. Kunc and R. M. Martin, Phys. Rev. Lett. 48, 406 (1982).
33. W. B. White and B. A. de Angelis, Spectrochim. Acta, Part A 32, 985 (1967).
34. F. D. Murnaghan, Proc. Natl. Acad. Sci. U.S.A. 30, 244 (1944).
35. D. M. Ceperley and B. J. Alder, Phys. Rev. Lett. 45, 566 (1980).
36. A. M. Appe, K. M. Rabe, E. Kaxiras, and J. D. Joannopoulos, Phys. Rev. B 41, 1227 (1990).
37. D. Vanderbilt, Phys. Rev. B 41, 7892 (1990).
38. G. Kresse and J. Hafner, J. Phys.: Condens. Matter 6, 8245 (1994).
39. CRC Handbook of Chemistry and Physics, edited by R. C. Weast (CRC Press, Boca Raton, FL, 1988).
40. D. Levy, A. Pavese, A. Sani, and V. Pischedda, Phys. Chem. Miner. 28, 612 (2001).
41. C. M. Fang and G. de With, Philos. Mag. A (to be published).
42. D. L. Price and K. Sköld, in Neutron Scattering, edited by K. Sköld and D. L. Price, (Academic, Orlando, 1986), Vol. A, p. 29.
43. V. S. Oskotskii, Fiz. Tverd. Tela (Leningrad) 9, 550 (1967) [Sov. Phys. Solid State 9, 420 (1967)].
44. M. M. Bredov, B. A. Kotov, N. M. Okuneva, V. S. Oskotskii, and A. L. Shakh-Budagov, Fiz. Tverd. Tela (Leningrad) 9, 287 (1967) [Sov. Phys. Solid State 9, 214 (1967)].
45. A. Sjölander, Ark. Fys. 14, 315 (1958).