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Irreversible immobile random adsorption of dimers, trimers, ... on 2D lattices
Author(s) -
R. S. Nord,
J. W. Evans
Publication year - 1985
Publication title -
the journal of chemical physics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.071
H-Index - 357
eISSN - 1089-7690
pISSN - 0021-9606
DOI - 10.1063/1.448279
Subject(s) - square lattice , trimer , lattice (music) , adsorption , dimer , statistical physics , saturation (graph theory) , physics , hexagonal lattice , chemical physics , chemistry , thermodynamics , combinatorics , mathematics , condensed matter physics , antiferromagnetism , acoustics , ising model , nuclear magnetic resonance
Models where pairs, triples, or larger (typically connected) sets of sites on a 2D lattice ‘‘fill’’ irreversibly (described here as dimer, trimer, ... filling or adsorption), either randomly or cooperatively, are required to describe many surface adsorption and reaction processes. Since filling is assumed to be irreversible and immobile (species are ‘‘frozen’’ once adsorbed), even the stationary, saturation state, which is nontrivial since the lattice cannot fill completely, is not in equilibrium. The kinetics and statistics of these processes are naturally described by recasting the master equations in hierarchic form for probabilities of subconfigurations of empty sites. These hierarchies are infinite for the infinite lattices considered here, but approximate solutions can be obtained by implementing truncation procedures. Those used here exploit a shielding property of suitable walls of empty sites peculiar to irreversible filling processes. Accurate results, including saturation coverage estimates, ar...

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