Original paper
Dynamics of Long Entangled Polyisoprene Melts via Multiscale Modeling
Abstract
A recently proposed hierarchical triple-scale simulation methodology (Behbahani et al., Macromolecules, 2021, 54, 2740–2762) is applied to cis-1,4 polyisoprene melts of a broad range of molecular weights, from oligomers to commercial-grade entangled materials. Dynamics are systematically probed over 12 orders of magnitude in time using a combination of atomistic and bottom-up parameterized coarse-grained and slip-spring simulations. Following...
Paper Details
Title
Dynamics of Long Entangled Polyisoprene Melts via Multiscale Modeling
Published Date
Sep 17, 2021
Journal
Volume
54
Issue
18
Pages
8693 - 8713
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Notes
History