Simulated annealing prediction of the crystal structure of ternary inorganic compounds using symmetry restrictions f

Journal of the Chemical Society, Dalton Transactions

Volumn , Issue 23, 2000, Pages 4258-4262

  Reinaudi, Luis ^a   Leiva, Ezcquicl P M ^a   Carbonio, Raûl E ^a  

^a DEPARTAMENTO DE FISICOQUÍMICA   (Argentina)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 1642519295     PISSN: 1470479X     EISSN: None     Source Type: Journal    
DOI: 10.1039/b003447i     Document Type: Article

References (14)

1. L. Reinaudi, R. E. Carbonio and E. P. M. Leiva, Cliein. Commun., 1998, 255.
2. J. Pannetier, J. Bassas-AIsina, J. Rodriguez-Carbajal and V. Caignacrt, Nature, 1990, 346, 343.
3. S. M. Woodley, P. D. Battle, J. D. Gale and C. R. A. Catlow, Phys. Client. Cliem. Phys., 1999, 1, 2535.
4. H. Putz, J. C. Schön and M. Jansen, J. Appl. Cryslallogr., 1999, 32, 864.
5. C. M. Freeman, J. M. Newsam, S. M. Levine and C. R. A. Catlow, J. Mater. Cliem., 1993, 3, 351.
6. Yu. A. Abramov, V. G. Tsirelson, V. E. Zavodnik, S. A. Ivanov and I. D. Brown, Ada Crystallogr., Sect. B, 1995, 51, 942.
7. A. Beran, E. Libowitzky and T. Armbruster, Can. Mineral, 1996, 34, 803.
8. J. Akimoto, Y. Gotoh and Y. Oosawa, Ada Crystallogr., Sect. C, 1994, 39, 160.
9. The code, compiled for the Windows, Linux and Alpha-Unix platforms, is available upon request at: carbonio@fisquim. fcq.unc.edu.ar.
10. J. Rodriguez-Carbajal, Physica B, 1993, 192, 55.
11. V. Nassif, R. E. Carbonio and J. A. Alonso, J. Solid Slate Chem., 1999, 146, 266.
12. H. Falcon, A. E. Goeta, G. Punte and R. E. Carbonio, J. Solid State Cliem., 1997, 133, 379.
13. C. R. A. Catlow, C. M. Freeman and R. L. Royle, Physica B, 1985, 131, 1.
14. G. V. Lewis, Physica B, 1985, 131, 114.