Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Statistical Approach with Kinetic Monte Carlo Simulation

Statistical Approach with Kinetic Monte Carlo Simulation... [Pg.166]

In this review we put less emphasis on the physics and chemistry of surface processes, for which we refer the reader to recent reviews of adsorption-desorption kinetics which are contained in two books [2,3] with chapters by the present authors where further references to earher work can be found. These articles also discuss relevant experimental techniques employed in the study of surface kinetics and appropriate methods of data analysis. Here we give details of how to set up models under basically two different kinetic conditions, namely (/) when the adsorbate remains in quasi-equihbrium during the relevant processes, in which case nonequilibrium thermodynamics provides the needed framework, and (n) when surface nonequilibrium effects become important and nonequilibrium statistical mechanics becomes the appropriate vehicle. For both approaches we will restrict ourselves to systems for which appropriate lattice gas models can be set up. Further associated theoretical reviews are by Lombardo and Bell [4] with emphasis on Monte Carlo simulations, by Brivio and Grimley [5] on dynamics, and by Persson [6] on the lattice gas model. [Pg.440]


See other pages where Statistical Approach with Kinetic Monte Carlo Simulation is mentioned: [Pg.414]    [Pg.204]    [Pg.191]    [Pg.194]    [Pg.395]    [Pg.488]    [Pg.170]    [Pg.44]    [Pg.110]    [Pg.129]    [Pg.236]    [Pg.1]    [Pg.192]    [Pg.5]    [Pg.7]    [Pg.137]    [Pg.367]    [Pg.2324]    [Pg.1405]    [Pg.368]   


SEARCH



Carlo Approaches

Carlo simulation

Kinetic Monte Carlo simulation

Kinetic approach

Kinetics Monte Carlo approach

Kinetics approach

Monte Carlo approach

Monte Carlo simulation

Monte simulations

Simulation kinetics

Simulation statistical simulations

Statistical simulations

© 2024 chempedia.info