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Diffusion in tight confinement: A lattice-gas cellular automaton approach. II. Transport properties.

Authors :
Demontis, Pierfranco
Pazzona, Federico G.
Suffritti, Giuseppe B.
Source :
Journal of Chemical Physics; 5/21/2007, Vol. 126 Issue 19, p194710, 8p, 1 Diagram, 8 Graphs
Publication Year :
2007

Abstract

In this second paper the authors study the transport properties of the lattice-gas cellular automaton presented in Paper I [J. Chem. Phys. 126, 194709 (2007)] to model adsorption and dynamics of particles in a lattice of confining cells. Their work shows how a surprisingly simple parallel rule applied to a static network of cells joined by links set in space and time can generate a wide range of dynamical behaviors. In their model the cells are the elementary constituent objects of the network. They are a portion of space structured in sites which are energetically different. Each cell can accommodate a given maximum number of particles, and each pair of neighboring cells can exchange at most one particle at a time. The predictions of the model are in qualitative agreement with both experimental observations and molecular dynamics simulation results. [ABSTRACT FROM AUTHOR]

Details

Language :
English
ISSN :
00219606
Volume :
126
Issue :
19
Database :
Complementary Index
Journal :
Journal of Chemical Physics
Publication Type :
Academic Journal
Accession number :
25183161
Full Text :
https://doi.org/10.1063/1.2721547