Strain induced crystallization of polymers at and above the crystallization temperature by coarse-grained simulations

We examine the behavior of short and long polymers by means of coarse-grained computer simulations of a by-polyvinyl alcohol inspired model. In particular, we focus on the structural changes in the monomer and polymer scales during cooling and the application of uni-axial true strain. The straining...

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Veröffentlicht in:The Journal of chemical physics 2021-06, Vol.154 (23), p.234902-234902
Hauptverfasser: Nagaraj, Hemanth, Clavier, Germain, Latour, Benoit, Dequidt, Alain, Devémy, Julien, Garruchet, Sébastien, Goujon, Florent, Martzel, Nicolas, Blaak, Ronald, Munch, Étienne, Malfreyt, Patrice
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Sprache:eng
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Zusammenfassung:We examine the behavior of short and long polymers by means of coarse-grained computer simulations of a by-polyvinyl alcohol inspired model. In particular, we focus on the structural changes in the monomer and polymer scales during cooling and the application of uni-axial true strain. The straining of long polymers results in the formation of a semi-crystalline system at temperatures well above the crystallization temperature, which allows for the study of strain induced crystallization.
ISSN:0021-9606
1089-7690
DOI:10.1063/5.0050562