화학공학소재연구정보센터
Chemical Physics Letters, Vol.336, No.1-2, 123-128, 2001
Novel Monte Carlo scheme for the simulation of adsorption and desorption processes
A novel Monte Carlo (MC) simulation scheme is presented which allows a rigorous simulation of adsorption, growth and desorption processes on surfaces. 2D equilibrium situations and the influence of severe kinetic limitations can be handled equally. The performance of the simulation scheme is demonstrated for the case of Xe adsorption on a Pt(1 1 1) surface with an intrinsic step density of about 0.5%.