30
Views
7
CrossRef citations to date
0
Altmetric
Original Articles

A Molecular Dynamics Simulation Study of the Density and Temperature Dependence of Self-diffusion in a “Sphere-cylinder” Micropore

&
Pages 121-134 | Received 01 Aug 1990, Accepted 01 Sep 1990, Published online: 23 Sep 2006

References

  • Evans , R. , Marini Bettolo Marconi , U. and Tarazona , P. Fluids in narrow pores: Adsorption, capillary condensation, and critical points . J. Chem. Phys. , 84 2376
  • Evans , R. , Marini Bettolo Marconi , U. and Tarazona , P. J. Chem. Soc. Faraday Trans. II , 82 1763
  • Peterson , B. K. , Walton , J. P.R.B. and Gubbins , K. E. Fluid behaviour in narrow pores . J. Chem. Soc. Faraday Trans II , 82 1789
  • Heinbuch , U. and Fischer , J. 1987 . Liquid argon in a cylindrical carbon pore: Molecular Dynamics and Born-Green-Yvon results . Chem. Phys. Let. , 135 ( 6 ) : 587 – 590 .
  • Aantonchenko , V. Ya. , Ilyin , V. V. , Makovsky , N. N. , Pavlov , A. N. and Sokhan , V. P. 1984 . On the nature of disjoining pressure oscillations in fluid films . Molecular Physics , 52 ( 2 ) : 345 – 355 .
  • Subramanian , S. and Davis , H. T. 1979 . Molecular Dynamics of a hard sphere fluid in small pores . Molecular Physics , 38 ( 4 ) : 1061 – 1066 .
  • Magda , J. J. , Tirrell , M. and Davis , H. T. 1985 . Molecular Dynamics of liquid-filled pores . J. Chem. Phys. , 83a ( 4 ) : 1888 – 1895 .
  • Peterson , L. B.K. and Gubbins , K. E. 1987 . Phase transitions in a cylindrical pore. Grand Canonical Monte Carlo, Mean Field theory and the Kelvin equation . Molecular Physics , 62 ( 1 ) : 215 – 226 .
  • Suh , S. H. and MacElroy , J. M.D. 1986 . Molecular Dynamics simulation of hindered diffusion in microcapillaries . Molecular Physics , 58 ( 3 ) : 445 – 473 .
  • Woods , G. B. , Panagiotopoulos , A. Z. and Rowlinson , J. S. 1988 . Adsorption of fluids in model zeolite cavities . Molecular Physics , 63 ( 1 ) : 49 – 63 .
  • Kanellopoulos , N. , Munday , K. A. and Nicholson , D. 1983 . The flow of a non-adsorbed, collisionless gas through linked spheres. A model for zeolite diffusion . J Membrane Science , 13 : 247 – 258 .
  • Mason , G. 1983 . A model of adsorption-desorption hysteresis in which hysteresis is primarily developed by the interconnection in a network of pores . Proc. Roy. Soc. , A390 : 47 – 72 .
  • Demi , T. and Nicholson , D. 1991 . Molecular dynamics simulation studies of the density and temperature dependence of self-diffusion in a cylindrical micropore . Molecular Simulation , 5 : 363 – 381 .
  • Hockney , R. W. 1956 . The potential calculation and some applications . Methods Comput. Phys. , 9 : 136 – 211 .
  • Potter , D. 1972 . Computational Physics , New York : Wiley .
  • Demi , T. 1989 . University of London . PhD thesis
  • McSchoen , Diestler , D. J. and Cushman , J. H. 1987 . Fluids in micropores. I. Structure of a simple classical fluid in a slit pore . J. Chem. Phys. , 87 : 5464 – 5470 .
  • Heyes , D. M. 1983 . Self-diffusion and shear viscosity of simple fluids . J. Chem. Faraday Trans. 2 , 79 : 1741 – 1747 .

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.