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Molecular Simulation Volume 44, 2018 - Issue 12
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Study on mechanical properties of polyethylene with chain branching in atomic scale by molecular dynamics simulation

Lijuan LiaoKey Laboratory for Mechanics in Fluid Solid Coupling Systems, Institute of Mechanics, Chinese Academy of Sciences, Beijing, ChinaCorrespondence[email protected]
ORCID Iconhttp://orcid.org/0000-0003-1753-6373
ORCID Icon,
Chenguang HuangKey Laboratory for Mechanics in Fluid Solid Coupling Systems, Institute of Mechanics, Chinese Academy of Sciences, Beijing, China;School of Engineering Science, University of Chinese Academy of Sciences, Beijing, China
&
Changyu MengKey Laboratory for Mechanics in Fluid Solid Coupling Systems, Institute of Mechanics, Chinese Academy of Sciences, Beijing, China;School of Engineering Science, University of Chinese Academy of Sciences, Beijing, China
Pages 1016-1024 | Received 14 Sep 2017, Accepted 28 Apr 2018, Published online: 10 May 2018

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Yongqin Zhang, Hua Yang, Yaguang Sun, Xiangrui Zheng & Yafang Guo. (2022) A molecular dynamics simulation on tunable and self-healing epoxy-polyimine network based on imine bond exchange reactions. Molecular Simulation 48:18, pages 1605-1615.
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Z. Yan, A. Zaoui & F. Zaïri. (2022) Uniaxial stretching and shape memory behavior of branched amorphous polyethylene. Chinese Journal of Physics 79, pages 6-12.
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Harikrishna Sahu, Kuan-Hsuan Shen, Joseph H. Montoya, Huan Tran & Rampi Ramprasad. (2022) Polymer Structure Predictor (PSP): A Python Toolkit for Predicting Atomic-Level Structural Models for a Range of Polymer Geometries. Journal of Chemical Theory and Computation 18:4, pages 2737-2748.
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Z Yan, A Zaoui & F Zaïri. (2021) Crystallization and mechanical behavior of semi-crystalline polyethylene. Physica Scripta 96:12, pages 125729.
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Ankur Chaurasia & Avinash Parashar. (2021) Effect of BNNR on mechanical properties of polyethylene nanocomposites. Materials Today: Proceedings 47, pages 2875-2877.
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Ankur Chaurasia, Avinash Parashar & Rahul S. Mulik. 2021. Advances in Engineering Design. Advances in Engineering Design 105 113 .
Chanwook Park, Jiwon Jung & Gun Jin Yun. (2020) A multiscale micromorphic model with strain rate relationship between MD simulations and macroscale experimental tests and dynamic heterogeneity for glassy polymers. Composites Part B: Engineering 202, pages 108439.
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F. Pashmforoush, S. Ajori & H.R. Azimi. (2020) Interfacial characteristics and thermo-mechanical properties of calcium carbonate/polystyrene nanocomposite. Materials Chemistry and Physics 247, pages 122871.
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Ankur Chaurasia, Akarsh Verma, Avinash Parashar & Rahul S. Mulik. (2019) Experimental and Computational Studies to Analyze the Effect of h-BN Nanosheets on Mechanical Behavior of h-BN/Polyethylene Nanocomposites. The Journal of Physical Chemistry C 123:32, pages 20059-20070.
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Xu Hua, Li Wang & Shanshui Yang. (2019) Molecular Dynamics Simulation of Improving the Physical Properties of Polytetrafluoroethylene Cable Insulation Materials by Boron Nitride Nanoparticle under Moisture-Temperature-Electric Fields Conditions. Polymers 11:6, pages 971.
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