Soret coefficient for liquid argon-krypton mixtures via equilibrium and nonequilibrium molecular dynamics: A comparison with experiments

Physical Review E - Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics

Volumn 66, Issue 3, 2002, Pages

  Perronace, A ^a   Ciccotti, G ^b   Leroy, F ^a   Fuchs, A H ^a   Rousseau, B ^a  

^a UNIVERSITÉ PARIS SUD   (France)

^b SAPIENZA UNIVERSITY OF ROME   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; COMPUTER SIMULATION; HEAT FLUX; KRYPTON; MIXTURES; MOLECULAR DYNAMICS; THERMODYNAMICS;

LIQUID ARGON-KRYPTON MIXTURES; NONEQUILIBRIUM MOLECULAR DYNAMICS; ONSAGER'S RECIPROCITY RELATIONS (ORR); RESPONSE THEORY;

ARGON;

ARTICLE;

EID: 41349110820     PISSN: 1063651X     EISSN: None     Source Type: Journal    
DOI: 10.1103/PhysRevE.66.031201     Document Type: Article

References (28)

1. D. MacGowan and D.J. Evans, Phys. Rev. A 34, 2133 (1986);
2. Phys. Rev. AD. MacGowanD.J. Evans 36, 948 (1987).
3. G.V. Paolini and G. Ciccotti, Phys. Rev. A 35, 5156 (1987).
4. P. Sindzingre, G. Ciccotti, C. Massobrio, and D. Frenkel, Chem. Phys. Lett. 136, 35 (1987).
5. R. Vogelsang, C. Hoheisel, G. Paolini, and G. Ciccotti, Phys. Rev. A 36, 3964 (1987).
6. D. Longrée, J. Legros, and G. Thomaes, J. Phys. Chem. 84, 3480 (1980).
7. D. Longrée, thèse de doctorat, Université Libre de Bruxelles, 1979.
8. S. de Groot and P. Mazur, Non-Equilibrium Thermodynamics (Dover, New York, 1984).
9. S. de Groot, Ph.D. thesis, Amsterdam, 1945.
10. W.W. Wood, J. Stat. Phys. 57, 675 (1989).
11. J. Irwing and J. Kirkwood, J. Chem. Phys. 18, 817 (1950).
12. D.J. Evans and P.T. Cummings, Mol. Phys. 72, 893 (1991).
13. S. Sarman and D.J. Evans, Phys. Rev. A 45, 2370 (1992).
14. S. Sarman and D.J. Evans, Phys. Rev. A 46, 1960 (1992).
15. R. Zwanzig, J. Chem. Phys. 40, 2527 (1964).
16. D.J. Evans, Phys. Lett. A 91A, 457 (1982).
17. D.J. Evans and G.P. Morriss, Statistical Mechanics of Nonequilibrium Liquids (Academic Press, New York, 1990).
18. B.L. Holian and D.J. Evans, J. Chem. Phys. 83, 3560 (1985).
19. P.J. Daivis and D.J. Evans, Chem. Phys. 198, 25 (1995).
20. G. Ciccotti, G. Jacucci, and I.R. McDonald, J. Stat. Phys. 21, 1 (1979).
21. G. Ciccotti, C. Pierleoni, and J. Ryckaert, in Microscopic Simulation of Complex Hydrodynamic Phenomena, edited by M. Marechal and B. Holian (Plenum Press, New York, 1992).
22. W.G. Hoover and W.T. Ashurst, in Theoretical Chemistry: Advances and Perspectives, edited by H. Eyring and D. Henderson (Academic Press, New York, 1975), Vol. 1, pp. 1–51.
23. C. Massobrio and G. Ciccotti, Phys. Rev. A 30, 3191 (1984).
24. M. Ferrario, G. Ciccotti, B.L. Holian, and J.P. Ryckaert, Phys. Rev. A 44, 6936 (1991).
25. A. Tenenbaum, G. Ciccotti, and R. Gallico, Phys. Rev. A 25, 2778 (1982).
26. B. Hafskjold and S.K. Ratkje, J. Stat. Phys. 78, 463 (1995).
27. J.-P. Ryckaert, A. Bellemans, G. Ciccotti, and G. Paolini, Phys. Rev. A 39, 259 (1989).
28. A. Perronace, C. Leppla, F. Leroy, B. Rousseau, and S. Wiegand, J. Chem. Phys. 116, 3718 (2002).