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Reduced plastic dilatancy in polymer glasses

Reduced plastic dilatancy in polymer glasses
Reduced plastic dilatancy in polymer glasses

Amorphous solids in general exhibit a volume change during plastic deformation due to microstructure change during plastic relaxation. Here the deformation dilatancy of alkane polymer glasses upon shearing is investigated using molecular static simulations at zero temperature and pressure. The dilatancy of linear alkane chains has been quantified as a function of strain and chain length. It is found that the system densities decrease linearly with respect to strain after yield point. In addition, dilatability decreases considerably with increasing chain length, suggesting enhanced cooperation of different deformation mechanisms. An analytic model is introduced for dilatability based on the atomistic study. The entanglement chain length is predicted as 43 for alkane polymers from the model, agreeing well with experiments. The study provides insights of correlations of the physical properties and chain length of polymers which might be useful in material design and applications of structural polymers.

alkane polymer glasses, dilatancy, molecular simulation, plastic deformation
1022-1344
Peng, Qing
5302092d-22de-4b60-abc4-3c10953590c5
Deng, Binghui
512be354-653c-445a-9f82-b0ea14dff44f
Utz, Marcel
c84ed64c-9e89-4051-af39-d401e423891b
Peng, Qing
5302092d-22de-4b60-abc4-3c10953590c5
Deng, Binghui
512be354-653c-445a-9f82-b0ea14dff44f
Utz, Marcel
c84ed64c-9e89-4051-af39-d401e423891b

Peng, Qing, Deng, Binghui and Utz, Marcel (2020) Reduced plastic dilatancy in polymer glasses. Macromolecular Theory and Simulations, 30 (2), [2000063]. (doi:10.1002/mats.202000063).

Record type: Article

Abstract

Amorphous solids in general exhibit a volume change during plastic deformation due to microstructure change during plastic relaxation. Here the deformation dilatancy of alkane polymer glasses upon shearing is investigated using molecular static simulations at zero temperature and pressure. The dilatancy of linear alkane chains has been quantified as a function of strain and chain length. It is found that the system densities decrease linearly with respect to strain after yield point. In addition, dilatability decreases considerably with increasing chain length, suggesting enhanced cooperation of different deformation mechanisms. An analytic model is introduced for dilatability based on the atomistic study. The entanglement chain length is predicted as 43 for alkane polymers from the model, agreeing well with experiments. The study provides insights of correlations of the physical properties and chain length of polymers which might be useful in material design and applications of structural polymers.

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More information

Accepted/In Press date: 20 November 2020
e-pub ahead of print date: 9 December 2020
Keywords: alkane polymer glasses, dilatancy, molecular simulation, plastic deformation

Identifiers

Local EPrints ID: 485457
URI: http://eprints.soton.ac.uk/id/eprint/485457
ISSN: 1022-1344
PURE UUID: 2bc602df-0151-40e5-b1fa-63007060542a
ORCID for Marcel Utz: ORCID iD orcid.org/0000-0003-2274-9672

Catalogue record

Date deposited: 06 Dec 2023 17:53
Last modified: 17 Mar 2024 03:30

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Contributors

Author: Qing Peng
Author: Binghui Deng
Author: Marcel Utz ORCID iD

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