Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5102520 | Physica A: Statistical Mechanics and its Applications | 2017 | 30 Pages |
Abstract
Monte Carlo simulation is used to study the adsorption-desorption kinetics in the framework of the kinetic lattice-gas model. Three schemes of the so-called hard dynamics and five schemes of the so called soft dynamics were used for this purpose. It is observed that for the hard dynamic schemes, the equilibrium and non-equilibrium observable, such as adsorption isotherms, sticking coefficients, and thermal desorption spectra, have a normal or physical sustainable behavior. While for the soft dynamics schemes, with the exception of the transition state theory, the equilibrium and non-equilibrium observables have several problems.
Related Topics
Physical Sciences and Engineering
Mathematics
Mathematical Physics
Authors
V.J. Huespe, R.E. Belardinelli, V.D. Pereyra, S.J. Manzi,