Plastic Deformation Mechanisms of Semicrystalline and Amorphous Polymers

Jabbari-Farouji, Sara; Rottler, Joerg; Lame, Olivier; Makke, Ali; Perez, Michel; Barrat, Jean-Louis

doi:10.1021/mz500754b

Cited by 150Polymer crystallization and propertiesMaterial Dynamics and PropertiesMicrostructure and mechanical properties

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Plastic Deformation Mechanisms of Semicrystalline and Amorphous Polymers

Jabbari-Farouji, Sara, Rottler, Joerg, Lame, Olivier, Makke, Ali, Perez, Michel, Barrat, Jean-Louis·2015·ACS Macro Letters

DOI 10.1021/mz500754b

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Abstract

We use large-scale molecular dynamics simulations to investigate plastic deformation of semicrystalline polymers with randomly nucleated crystallites. The strain-softening regime is dominated by deformation of crystallites via reorientation of chain-folded lamellae toward the tensile axis, fragmentation of largest crystalline domains, and a partial loss of crystallinity. The strain-hardening regime coincides with unfolding of chains and recrystallization as a result of strain-induced chain alignment. These observed deformation mechanisms are consistent with experimental findings. We compare the tensile behavior of semicrystalline polymers with their amorphous counterparts at temperatures above and below the glass transition temperature.

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As a result of the high cooling rates and homogeneous nucleation, only co-crystallization of the long and short chains was observed.
“As a result of the high cooling rates and the fact that nucleation was homogeneous [18,75], only co-crystallization of the long and short chains was observed (Fig. 6).”
From Molecular dynamics simulation of linear polyethylene blends: Effect of molar mass bimodality on topological characteristics and mechanical behavior (2019) · cites this paper as [75]

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Authors: Jabbari-Farouji, S., Rottler, J., Lame, O., Makke, A., Perez, M., & Barrat, J.-L.
Affiliations: Université Grenoble Alpes, UJF Liphy, F38041 Grenoble, France
Department of Physics and Astronomy, The University of British Columbia, 6224 Agricultural Road, Vancouver, British Columbia V6T 1Z1, Canada
Centre National de la Recherche Scientifique (FR)
Université Joseph Fourier (FR)
ORCID: Perez, Michel
Barrat, Jean-Louis
Venue: ACS Macro Letters
Publisher: American Chemical Society (ACS)
Published: 2015-01-14
Volume: 4
Issue: 2
Pages: 147-150
ISSN: 2161-1653 (ISSN-L)
DOI: 10.1021/mz500754b
OpenAlex: W2314025514
Cited by: 147
References: 21
Citations by year: 2026: 19 · 2025: 11 · 2024: 19 · 2023: 14 · 2022: 16 · 2021: 15 · 2020: 10 · 2019: 11 · 2018: 16 · 2017: 9 · 2016: 5 · 2015: 2
FWCI: 6.84
Type: journal article
Language: en
Open access: closed
Locations: ACS Macro Letters (publishedVersion)
PubMed (publishedVersion)
HAL (submittedVersion)
Funders: Institut Universitaire de France
Topics: Physical Sciences › Materials Science › Polymers and Plastics › Polymer crystallization and properties
Physical Sciences › Materials Science › Materials Chemistry › Material Dynamics and Properties
Physical Sciences › Materials Science › Metals and Alloys › Microstructure and mechanical properties
Keywords: plastic deformation, semicrystalline polymers, amorphous polymers, strain softening, strain hardening, recrystallization, chain orientation, glass transition temperature, tensile properties

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Plastic Deformation Mechanisms of Semicrystalline and Amorphous Polymers

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