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石墨烯添加剂对UHMWPE摩擦学特性影响的分子模拟研究*
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大连海事大学

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基金项目:

国家自然科学基金项目(51909023);中央高校基本科研业务费专项资金资助(3132023122;3132023516).


Molecular Simulation Study on the Effect of Graphene Additives on the Tribological Properties of UHMWPE
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Affiliation:

Dalian Maritime University

Fund Project:

National Natural Science Foundation of China, No. 51909023; Basic Scientific Research Funds of Central universities (3132023122; 3132023516).

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    摘要:

    本研究采用分子动力学模拟的方法,研究了石墨烯作为添加剂影响超高分子量聚乙烯(UHMWPE)摩擦学特性。结果表明,石墨烯位于铁与UHMWPE摩擦界面处时,随石墨烯含量的增加表层UHMWPE沿摩擦方向的摩擦力下降,减弱了表层UHMWPE的塑性变形。石墨烯位于UHMWPE内部时,因石墨烯与周围聚乙烯分子链之间存在吸附作用,随石墨烯含量的增加表层UHMWPE塑性变形程度越小。同时发现,石墨烯位于UHMWPE内部时,会向UHMWPE内部扩散,并在扩散过程中延缓其周围聚乙烯链的解缠结过程,从而不利于UHMWPE塑性变形,但会引起UHMWPE表层摩擦力增大。

    Abstract:

    In this study, the effects of graphene as an additive on the tribological properties of ultra-high molecular weight polyethylene (UHMWPE) were studied by molecular dynamics simulation. The results showed that the frictional force decreased with the increase of graphene content in the friction model that graphene was located at the friction interface between iron and UHMWPE. Meanwhile, the plastic deformation of UHMWPE was also weakened. When the graphene is located in the subsurface layer of UHMWPE, because of the attractive interaction between the graphene and surrounding polyethylene chains, the plastic deformation of surface UHMWPE decreases with the increase of graphene content. At the same time, it was found that the graphene had a tendency to diffuse into UHMWPE during the frictional process. As a result, the polyethylene chains around graphene disentangled more slowly, which weakens the plastic `deformation of the surface UHMWPE but causes the increase of the frictional force of UHMWPE. Keywords: UHMWPE, Graphene, Friction, Deformation, Molecular Simulation

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  • 收稿日期:2024-02-05
  • 最后修改日期:2024-03-20
  • 录用日期:2024-03-29
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