Molecular dynamics study on the thermal conductivity of a single polyethylene chain: Strain dependence and potential models’ effect
The thermal conductivity of a single polymer chain, which is an important factor in the rational design of polymer-based thermal management materials, is strongly affected by the strain state of the chain. In the present study, using non-equilibrium molecular dynamics simulations, the thermal conduc...
Main Authors: | , , , |
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Format: | Article |
Language: | English |
Published: |
AIP Publishing LLC
2022-10-01
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Series: | AIP Advances |
Online Access: | http://dx.doi.org/10.1063/5.0095975 |