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Chemical Physics Letters, Vol.643, 1-5, 2016
The adsorption of methyl methacrylate and vinyl acetate polymers on alpha-quartz surface: A molecular dynamics study
The molecular dynamics simulation was used to investigate the adsorption of polymethyl methacrylate (PMMA) and polyvinyl acetate (PVA), the commonly used surface coating materials, on a-quartz surface. The objective is to understand the interactions between quartz surface and polymers. The results clearly show adsorption of both polymers onto the quartz surface. Carbonyl group plays a significant role in the adsorption process. The adsorption energies of PMMA and PVA on a-quartz surface did not show significant difference, however, more hydrogen bonds were observed on the PVA/quartz system than PMMA/quartz. These observations might offer some insights on the polymer-quartz adhesion and its failure mechanism. (C) 2015 Elsevier B.V. All rights reserved.