Isolating the Effect of Crosslink Densities on Mechanical Properties of Isotactic Polypropylene Using Dissipative Particle Dynamics

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چکیده

Front Cover: In article number 2300014, Yoshitake Suganuma and James A. Elliott investigate the effect of crosslink density on mechanical properties isotactic polypropylene (iPP) by dissipative particle dynamics (DPD) method. Coarse-grained structures iPP (blue chains) with different numbers crosslinks (magenta spheres) are developed from an all-atom model Bayesian optimization, their tensile tests performed in DPD simulations.

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ژورنال

عنوان ژورنال: Macromolecular Theory and Simulations

سال: 2023

ISSN: ['1022-1344', '1521-3919']

DOI: https://doi.org/10.1002/mats.202370007