Study of adsorption of binary mixtures on disordered substrates

被引:24
作者
Bulnes, F [1 ]
Ramirez-Pastor, AJ [1 ]
Pereyra, VD [1 ]
机构
[1] CONICET, UNSL, Dept Fis, Lab Cs Superficies & Medicon Porosos, RA-5700 San Luis, Argentina
关键词
adsorption; heterogeneous surfaces; Monte Carlo simulation;
D O I
10.1016/S1381-1169(00)00500-8
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The adsorption of binary mixtures on solid heterogeneous substrates is studied by Monte Carlo simulation in the framework of the lattice gas model. The energy of the surface has been modeled by considering two kind of adsorption sites, deep and shallow traps, forming square homogeneous patches of different sizes; these adsorption domains have been distributed either at random or in chessboard-like lattice to obtain simple heterogeneous topographies. The adsorption process has been monitored through total and partial isotherms and differential heats of adsorption corresponding to both species of the mixture, for different values of the parameters involved in the model (lateral interactions, energy gap between deep and shallow patches) and different topographies. A rich variety of behaviors is found and analyzed in the context of the lattice gas theory. (C) 2001 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:129 / 139
页数:11
相关论文
共 26 条
[1]  
[Anonymous], 1992, ADSORPTION GASES HET, DOI DOI 10.1016/B978-0-12-601690-1.50015-1
[2]   GRAND CANONICAL ENSEMBLE COMPUTER-SIMULATION OF ADSORPTION OF ARGON ON A HETEROGENEOUS SURFACE [J].
BAKAEV, VA ;
STEELE, WA .
LANGMUIR, 1992, 8 (01) :148-154
[3]  
Binder K., 1979, Monte Carlo methods in statistical physics. Topics in current physics
[4]   Adsorption of binary mixtures on heterogeneous surfaces [J].
Bulnes, F ;
Ramirez-Pastor, AJ ;
Riccardo, JL ;
Pereyra, V .
ADSORPTION SCIENCE AND TECHNOLOGY, 2000, :517-521
[5]   Calorimetric heats of adsorption and adsorption isotherms .1. O-2, N-2, Ar, CO2, CH4, C2H6 and SF6 on silicalite [J].
Dunne, JA ;
Mariwals, R ;
Rao, M ;
Sircar, S ;
Gorte, RJ ;
Myers, AL .
LANGMUIR, 1996, 12 (24) :5888-5895
[6]   Calorimetric heats of adsorption and adsorption isotherms .2. O-2, N-2, Ar, CO2, CH4, C2H6, and SF6 on NaX, H-ZSM-5, and Na-ZSM-5 zeolites [J].
Dunne, JA ;
Rao, M ;
Sircar, S ;
Gorte, RJ ;
Myers, AL .
LANGMUIR, 1996, 12 (24) :5896-5904
[7]  
FLOOD EA, 1967, SOLID GAS INTERFACE
[8]   SYNERGISM AT A LIQUID-SOLID INTERFACE - ADSORPTION OF BINARY-MIXTURES OF BILE-SALTS ONTO A CHOLESTEROL SURFACE [J].
GONZALEZCABALLERO, F ;
KERKEB, ML .
LANGMUIR, 1994, 10 (04) :1268-1273
[9]   Adsorption of CH4-CF4 mixtures in silicalite: Simulation, experiment, and theory [J].
Heuchel, M ;
Snurr, RQ ;
Buss, E .
LANGMUIR, 1997, 13 (25) :6795-6804
[10]  
Hill T. L., 1962, An Introduction to Statistical Thermodynamics