Jw. Jiang et al., LATTICE MONTE-CARLO SIMULATION OF POLYMER ADSORPTION AT AN INTERFACE,2 - POLYDISPERSE POLYMER, Macromolecular theory and simulations, 7(1), 1998, pp. 113-117
Competitive adsorption of polydisperse polymers at a solid-liquid inte
rface is studied by Monte Carlo simulation (MC). The dynamic process o
f adsorption prior to equilibrium is traced. Changing fractionation is
observed during the process of adsorption. Shorter chains are prefere
ntially adsorbed due to the quick diffusion onto the interface at the
beginning stage. However, the preadsorbed shorter chains are gradually
displaced by the longer chains to enhance the stabilization of the sy
stem. At equilibrium, the distributions total segment density and diff
erent adsorption configurations including trains, loops and tails are
calculated. Segment fractions of polymers, both adsorbed and in soluti
on, are also estimated. Comparisons with those predicted from Scheutje
ns-Fleer theory are further investigated. In contrast to monodisperse
polymer adsorption, relatively large discrepancies are found between t
heoretical predictions and MC results in this mixed-polymer adsorption
case.