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Self‐sustained entropy‐driven flow in nano‐confined polymer melts
Authors:Yves Termonia
Affiliation:Central Research and Development, Polymer Processing and Characterization, Building E304, Room C219, Experimental Station, E.I. DuPont de Nemours, Inc., Wilmington, Delaware
Abstract:We present a Monte Carlo simulation study of the Brownian motion of polymer chains in a melt confined in a periodically asymmetric channel of nanometric dimensions. We assume no friction between the chains and the channel. A detailed analysis of the conformations of the chains reveals the presence of a favorable entropy gradient along the easy flow direction. For high molecular weight chains, this gradient is seen to drive a self‐sustained polymer flow with Peclet numbers as high as 0.9, which makes our observation experimentally accessible. Much weaker efficiences are observed at low molecular weights. We show that the unexpected directed Brownian motion of polymers in confined geometries is of significant importance in the design and stabilization of platelet nanocomposites which typically age over time under quiescent conditions. © 2015 Wiley Periodicals, Inc. J. Polym. Sci., Part B: Polym. Phys. 2015 , 53, 869–875
Keywords:computer modeling  Monte Carlo simulation  nanotechnology  nanocomposites
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