Energy Renormalization Method for the Coarse-Graining of Polymer Viscoelasticity.
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DOI: 10.1021/acs.macromol.7b02560
Abstract: Developing temperature transferable coarse-grained (CG) models is essential for the computational prediction of polymeric glass-forming (GF) material behavior, but their dynamics are often greatly altered from those of all-atom (AA) models mainly because of the… read more here.
Keywords: coarse graining; polymer viscoelasticity; energy renormalization; coarse ... See more keywords