Crystals of binary Lennard-Jones solids

Physical Review B - Condensed Matter and Materials Physics

Volumn 64, Issue 18, 2001, Pages

  Middleton, Thomas F ^a   Mortenson, Paul N ^a   Wales, David J ^a   Hernández Rojas, Javier ^b  

^a UNIVERSITY OF CAMBRIDGE   (United Kingdom)

^b UNIVERSIDAD DE LA LAGUNA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ARTICLE; CRYSTAL STRUCTURE; CRYSTALLIZATION; ENERGY; MOLECULAR DYNAMICS; PHASE TRANSITION;

EID: 0035509254     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.64.184201     Document Type: Article

References (50)

1. W. Kob and H C. Andersen, Phys. Rev. Lett.73, 1376 (1994).
2. W. Kob and H C. Andersen, Phys. Rev. E51, 4626 (1995).
3. S. Sastry, P G. Debenedetti, and F H. Stillinger, Nature (London)393, 554 (1998).
4. J E. Lennard-Jones, Proc. R. Soc. London, Ser. A106, 463 (1924).
5. S D. Stoddard and J. Ford, Phys. Rev. A8, 1504 (1973).
6. F. Sciortino and P. Tartaglia, Phys. Rev. Lett.86, 107 (2001).
7. T A. Weber, and F H. Stillinger, Phys. Rev. B31, 1954 (1985).
8. R M. Ernst, S R. Nagel, and G S. Grest, Phys. Rev. B43, 8070 (1991).
9. C A. Angell, B E. Chards, and V. Velikov, J. Phys.: Condens. Matter11, A75 (1999).
10. F. Sciortino, W. Kob, and P. Tartaglia, Phys. Rev. Lett.83, 3214 (1999).
11. T B. Schroder, S. Sastry, J C. Dyre, and S C. Glotzer, J. Chem. Phys.112, 9834 (2000).
12. C. Donati, F. Sciortino, and P. Tartaglia, Phys. Rev. Lett.85, 1464 (2000).
13. S. Sastry, Phys. Rev. Lett.85, 590 (2000).
14. S. Sastry, J. Phys.: Condens. Matter12, 6515 (2000).
15. F. Sciortino, W. Kob, and P. Tartaglia, J. Phys.: Condens. Matter12, 6525 (2000).
16. L. Angelani, R. Di Leonardo, G. Ruocco, A. Scala, and F. Sciortino, Phys. Rev. Lett.85, 5356 (2000).
17. K. Broderix, K K. Bhattacharya, A. Cavagna, A. Zippelius, and I. Giardina, Phys. Rev. Lett.85, 5360 (2000).
18. J.-L. Barrat, M. Baus, and J.-P. Hansen, Phys. Rev. Lett.56, 1063 (1986).
19. J.-L. Barrat, M. Baus, and J.-P. Hansen, J. Phys. C20, 1413 (1987).
20. W. Hume-Rothery, R E. Smallman, and C W. Haworth, The Structure of Metals and Alloys (The Metals and Metallurgy Trust, London, 1969).
21. Z. Li and H A. Scheraga, Proc. Natl. Acad. Sci. U.S.A.84, 6611 (1987).
22. D J. Wales and J P K. Doye, J. Phys. Chem. A101, 5111 (1997).
23. J. Hernández-Rojas and D J. Wales, J. Non-Cryst. Solids (to be published).
24. D J. Wales and H A. Scheraga, Science285, 1368 (1999).
25. T F. Middleton and D J. Wales, Phys. Rev. B64, 024205 (2001).
26. International Tables for Crystallography, edited by T. Hahn, Space Group Symmetry, Vol. A (International Union of Crystallography, Dordrecht, Holland, 1983).
27. A. Bowman, G. Arnold, and N. Krikorian, Acta Crystallogr., Sect. B: Struct. Crystallogr. Cryst. Chem.27, 1067 (1971).
28. D. Fletcher, R. McMeeking, and D. Parkin, J. Chem. Inf. Comput. Sci.36, 746 (1996).
29. D J. Wales, J P K. Doye, A. Dullweber, M P. Hodge, F Y. Naumkin, F. Calvo, J. Hernández-Rojas, and T F. Middleton, The Cambridge Cluster Database, URL: http://www-wales.ch.cam.ac.uk/CCD.html (2001).
30. D. Liu and J. Nocedal, Math. Prog.45, 503 (1989).
31. G M. Crippen and H A. Scheraga, Arch. Biochem. Biophys.144, 462 (1971).
32. J. Pancíř, Collect. Czech. Chem. Commun.40, 1112 (1974).
33. R L. Hilderbrandt, Comput. Chem. (Oxford)1, 179 (1977).
34. C J. Cerjan and W H. Miller, J. Chem. Phys.75, 2800 (1981).
35. D J. Wales, J. Chem. Phys.101, 3750 (1994).
36. D J. Wales and T R. Walsh, J. Chem. Phys.105, 6957 (1996).
37. L J. Munro and D J. Wales, Phys. Rev. B59, 3969 (1999).
38. D J. Wales, J. Chem. Phys.91, 7002 (1989).
39. D J. Wales, Chem. Phys. Lett.166, 419 (1990).
40. O M. Becker and M. Karplus, J. Chem. Phys.106, 1495 (1997).
41. D J. Wales, J P K. Doye, M A. Miller, P N. Mortenson, and T R. Walsh, Adv. Chem. Phys.115, 1 (2000).
42. Y. Levy and O M. Becker, Phys. Rev. Lett.81, 1126 (1998).
43. J P K. Doye, M A. Miller, and D J. Wales, J. Chem. Phys.111, 8417 (1999).
44. M A. Miller, J P K. Doye, and D J. Wales, J. Chem. Phys.110, 328 (1999).
45. O K. Rice and H C. Ramsperger, J. Am. Chem. Soc.49, 1617 (1927).
46. L S. Kassel, J. Phys. Chem.32, 225 (1928).
47. A. Marcus and O K. Rice, J. Phys. Colloid Chem.55, 894 (1951).
48. D J. Wales, M A. Miller, and T R. Walsh, Nature (London)394, 758 (1998).
49. D J. Wales and J P K. Doye, Phys. Rev. B63, 214204 (2001).
50. S. Sastry, Nature (London)409, 164 (2001).