A mesoscopic model with vectorial structure parameter for interacting star polymers

Journal Article (2018)
Author(s)

Barry W. Fitzgerald (TU Delft - Intensified Reaction and Separation Systems)

Wim J. Briels (University of Twente, Forschungszentrum Jülich)

Research Group
Intensified Reaction and Separation Systems
DOI related publication
https://doi.org/10.1002/mats.201700069
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Publication Year
2018
Language
English
Research Group
Intensified Reaction and Separation Systems
Volume number
27

Abstract

An updated mesoscopic model for transient forces between two star polymers is presented. Calculation of the transient forces is based on the response of a vectorial structure parameter between two star polymers and differs from previous models that used a scalar structure parameter. The update of the model is motivated by the occurrence of two distinct processes in previous small-scale simulations of two star polymers moving past each other. A simple model that takes these processes into account turns out to fit into an obvious generalization of the RaPiD model introduced by us some time ago. The model reproduces forces from the simulation quite well, and at the same time removes an unphysical feature of the RaPiD model used so far.

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