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Coarse-grained simulations of flow-induced nucleation in semicrystalline polymers.
MedLine Citation:
PMID:  19792384     Owner:  NLM     Status:  PubMed-not-MEDLINE    
Abstract/OtherAbstract:
We perform kinetic Monte Carlo simulations of flow-induced nucleation in polymer melts with an algorithm that is tractable even at low undercooling. The configuration of the noncrystallized chains under flow is computed with a recent nonlinear tube model. Our simulations predict both enhanced nucleation and the growth of shish-like elongated nuclei for sufficiently fast flows. The simulations predict several experimental phenomena and theoretically justify a previously empirical result for the flow-enhanced nucleation rate. The simulations are highly pertinent to both the fundamental understanding and process modeling of flow-induced crystallization in polymer melts.
Authors:
Richard S Graham; Peter D Olmsted
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Publication Detail:
Type:  Journal Article     Date:  2009-09-10
Journal Detail:
Title:  Physical review letters     Volume:  103     ISSN:  0031-9007     ISO Abbreviation:  Phys. Rev. Lett.     Publication Date:  2009 Sep 
Date Detail:
Created Date:  2009-10-01     Completed Date:  2009-10-20     Revised Date:  -    
Medline Journal Info:
Nlm Unique ID:  0401141     Medline TA:  Phys Rev Lett     Country:  United States    
Other Details:
Languages:  eng     Pagination:  115702     Citation Subset:  -    
Affiliation:
School of Mathematical Sciences, University of Nottingham, Nottingham NG7 2RD, United Kingdom.
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