Lattice density functional theory predictions of order-disorder phase transitions

Journal of Chemical Physics

Volumn 112, Issue 5, 2000, Pages 2361-2366

  Aranovich, G L ^a   Donohue, M D ^a  

^a Johns Hopkins University   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001077678     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.480802     Document Type: Article

References (50)

1. D. A. Young, J. Chem. Phys. 58, 1647 (1973).
2. A. R. Denton and N. W. Ashcroft, Phys. Rev. A 42, 7312 (1990).
3. X. C. Zeng and D. W. Oxtoby, J. Chem. Phys. 93, 2692 (1990); 93, 4357 (1990).
4. X. C. Zeng and D. W. Oxtoby, J. Chem. Phys. 93, 2692 (1990); 93, 4357 (1990).
5. C. Vega, E. P. A. Paras, and P. A. Monson, J. Chem. Phys. 97, 8543 (1992).
6. P. Bolhuis and D. Frenkel, Phys. Rev. Lett. 72, 2211 (1994).
7. D. A. Kofke, Phys. Rev. E 59, 618 (1999).
8. C. Vega, E. P. A. Paras, and P. A. Monson, Mol. Phys. 77, 803 (1992).
9. W. G. Hoover and F. Ree, J. Chem. Phys. 49, 3609 (1968).
10. J. A. Barker, J. Chem. Phys. 44, 4212 (1966).
11. D. Henderson and J. A. Barker, Mol. Phys. 14, 587 (1968).
12. J. A. Barker, J. Chem. Phys. 63, 632 (1975).
13. A. D. J. Haymet, Annu. Rev. Phys. Chem. 38, 89 (1987); M. Baus, J. Stat. Phys. 48, 1129 (1987); M. Baus, J. Phys.: Condens. Matter 2, 2111 (1990).
14. A. D. J. Haymet, Annu. Rev. Phys. Chem. 38, 89 (1987); M. Baus, J. Stat. Phys. 48, 1129 (1987); M. Baus, J. Phys.: Condens. Matter 2, 2111 (1990).
15. A. D. J. Haymet, Annu. Rev. Phys. Chem. 38, 89 (1987); M. Baus, J. Stat. Phys. 48, 1129 (1987); M. Baus, J. Phys.: Condens. Matter 2, 2111 (1990).
16. P. Tarazona, Phys. Rev. A 31, 2672 (1985).
17. G. L. Aranovich and M. D. Donohue, Phys. Rev. E 60, 5552 (1999).
18. N. A. Modine, G. Zumbach, and E. Kaxiras, Phys. Rev. B 55, 10289 (1997).
19. W. G. Kranedonk and D. Frenkel, Mol. Phys. 72, 679 (1991); D. Kofke, Mol. Simul. 7, 285 (1991).
20. W. G. Kranedonk and D. Frenkel, Mol. Phys. 72, 679 (1991); D. Kofke, Mol. Simul. 7, 285 (1991).
21. C. N. Yang and T. D. Lee, Phys. Rev. 87, 410 (1952).
22. L. K. Runnels, in Lattice Gas Theories of Melting, Phase Transitions and Critical Phenomena, edited by G. Domb and M. S. Green (Academic, New York, 1972), Vol. 3, pp. 305-329.
23. F. H. Ree and D. A. Chesnut, Phys. Rev. Lett. 18, 5 (1967).
24. L. K. Runnels, J. P. Salvant, and H. R. Streiffer, J. Chem. Phys. 52, 2352 (1970).
25. B. Widom and J. S. Rowlinson, J. Chem. Phys. 52, 1670 (1970).
26. J. L. Lebowitz, A. Mazel, P. Nielaba, and L. Samaj, Phys. Rev. E 52, 5985 (1995).
27. B. R. Riemenschneider and D. A. Huckaby, J. Chem. Phys. 58, 3940 (1973).
28. D. A. Huckaby, Phys. Rev. B 20, 1208 (1979).
29. D. A. Huckaby, J. Stat. Phys. 33, 23 (1983).
30. D. A. Huckaby, Lect. Notes Phys. 206, 290 (1984).
31. S. Ono and S. Kondo, in Encyclopedia of Physics, edited by S. Flügge (Springer-Verlag, Berlin, 1960), Vol. 10.
32. J. S. Rowlinson and B. Widom, Molecular Theory of Capillarity (Clarendon, Oxford, 1982), Sec. 5.3.
33. G. L. Aranovich and M. D. Donohue, J. Chem. Phys. 105, 7059 (1996).
34. G. L. Aranovich and M. D. Donohue, Physica A 242, 409 (1997).
35. G. L. Aranovich, T. Hocker, D. W. Wu, and M. D. Donohue, J. Chem. Phys. 106, 10282 (1997).
36. C. Domb, Adv. Phys. 9, 150 (1960).
37. C. Domb, in Phase Transitions and Critical Phenomena, edited by C. Domb and M. S. Green (Academic, London-New York, 1974), Vol. 3, pp. 1-95; M. E. Fisher, Rep. Prog. Phys. 30, 731 (1967).
38. C. Domb, in Phase Transitions and Critical Phenomena, edited by C. Domb and M. S. Green (Academic, London-New York, 1974), Vol. 3, pp. 1-95; M. E. Fisher, Rep. Prog. Phys. 30, 731 (1967).
39. R. Kikuchi, Phys. Rev. 81, 988 (1951).
40. J. M. Sanchez and D. de Fontaine, Phys. Rev. B 17, 2926 (1978).
41. J. W. Cahn and R. Kikuchi, Phys. Rev. B 31, 4300 (1985).
42. M. Blume, V. J. Emery, and R. B. Griffiths, Phys. Rev. A 4, 1071 (1971).
43. K. Sasaki and R. B. Griffiths, J. Stat. Phys. 53, 1031 (1988); L.-H. Tang and R. B. Griffiths, ibid. 53, 853 (1988); K. E. Bassler, K. Sasaki, and R. B.Griffiths, ibid. 62, 45 (1991).
44. K. Sasaki and R. B. Griffiths, J. Stat. Phys. 53, 1031 (1988); L.-H. Tang and R. B. Griffiths, ibid. 53, 853 (1988); K. E. Bassler, K. Sasaki, and R. B.Griffiths, ibid. 62, 45 (1991).
45. K. Sasaki and R. B. Griffiths, J. Stat. Phys. 53, 1031 (1988); L.-H. Tang and R. B. Griffiths, ibid. 53, 853 (1988); K. E. Bassler, K. Sasaki, and R. B.Griffiths, ibid. 62, 45 (1991).
46. G. L. Aranovich, P. S. Donohue, and M. D. Donohue, J. Chem. Phys. (in press).
47. G. A. Korn and T. M. Korn, Mathematical Handbook for Scientists and Engineers (McGraw-Hill, New York, 1961).
48. K. Binder, in Monte Carlo Methods in Statistical Physics, edited by K. Binder (Springer-Verlag, Berlin, 1979), Chap. 1.
49. J. M. Prausnitz, Molecular Thermodynamics of Fluid-Phase Equilibria (Prentice-Hall, Englewood Cliffs, New Jersey, 1969).
50. N. G. Parsonage and L. A. K. Staveley, Disorder in Crystals (Clarendon, New York, 1978).