空间滚动轴承MoS2薄膜润滑分子动力学模拟*
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国家自然科学基金资助项目(51775072);重庆市科技创新领军人才支持计划项目(CSTCCCXLJRC201920);重庆市高校创新研究群体(CXQT20019);重庆市北碚区科学技术局技术创新与应用示范项目(2020-5)


Molecular dynamics simulation of lubrication of space rolling bearing MoS2 film
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National Natural Science Foundation of China, No.51775072; Chongqing Science and Technology Innovation Leading Talents Support Program, No.CSTCCCXLJRC201920; Chongqing University Innovation Research Group, No.CXQT20019; Technology Innovation and Application Demonstration Project of Chongqing Beibei Science and Technology Bureau, No.2020-5

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    摘要:

    空间滚动轴承通常使用二硫化钼进行固体润滑,在太空难以对固体润滑剂进行添补因此对轴承的润滑性能存在一定挑战。针对空间滚动轴承往复运动状态下二硫化钼薄膜润滑失效机理不明的难题,提出了采用分子动力学对薄膜润滑过程进行分析的方法。首先以FeNiCr合金作为基底与探针建立了单层二硫化钼薄膜摩擦原子模型,通过构建混合势函数来对原子间的相互作用关系进行描述,其次针对载荷和环境温度这两个空间滚动轴承的重要影响因素展开了二硫化钼薄膜的往复摆动模拟,最后得到了摩擦过程中二硫化钼薄膜的摩擦力、粘附力和磨损情况,并通过计算薄膜的摩擦系数对润滑失效进行判断得出结论。模拟结果表明:1)FeNiCr合金探针在单层二硫化钼薄膜上的摩擦为粘滑运动,载荷在20-100nN范围内探针的摩擦过程不会对薄膜造成磨损但在往复运动过程中润滑性能有所提高。载荷从200nN开始探针的摩擦过程会对薄膜造成磨损,往复运动过程中摩擦系数不断提高润滑性能下降。400nN为单层薄膜的载荷极限,在该载荷下探针会刺穿薄膜与基底接触此时薄膜迅速磨损失去润滑作用;2)环境温度在1773.15K以下对薄膜的润滑作用影响不明显,但达到该温度后薄膜边界处会开始缓慢的熔化,当环境温度达到二硫化钼熔点时薄膜的熔化速度会加快失去润滑作用。结论:1)二硫化钼单层薄膜的接触载荷在8Gpa以下拥有优异的耐磨性和润滑性;2)在薄膜为破损的条件下,反复摩擦过程会对润滑性能带来提升;3)二维层状结构对单层二硫化钼薄膜润滑性能有重要的影响,高温和重载都会对薄膜层状结构造成破坏。

    Abstract:

    Space rolling bearings usually use molybdenum disulfide for solid lubrication, and it is difficult to replenish the solid lubricant in space so there are some challenges for the lubrication performance of the bearings. For the space rolling bearing reciprocating motion state molybdenum disulfide film lubrication failure mechanism is unknown, proposed a method to analyze the film lubrication process using molecular dynamics. Firstly, a single-layer molybdenum disulfide film friction atomic model is established with FeNiCr alloy as the substrate and probe, and the inter-atomic interaction relationship is described by constructing a mixed potential function, followed by the reciprocating oscillation simulation of molybdenum disulfide film for normal load and ambient temperature, which are two important influencing factors of space rolling bearing. The friction force, adhesion and wear of the molybdenum disulfide film during the friction process are finally obtained, and conclusions are drawn by calculating the friction coefficient of the film to judge the lubrication failure. The simulation results show that: 1) the friction of the FeNiCr alloy probe on the monolayer molybdenum disulfide film is stick-slip motion, and the friction process of the probe does not cause wear to the film in the load range of 20-100nN, but the lubrication performance is improved during the reciprocating motion. Normal load from 200nN onwards, the friction process of the probe will cause wear to the film, and the lubricity will decrease during the reciprocating motion. 400nN is the load limit of the single-layer film, at this load the probe will pierce the film and contact with the substrate, then the film wears rapidly and loses its lubricity; 2) the ambient temperature below 1773.15K has no obvious effect on the lubricity of the film, but When the ambient temperature reaches the melting point of molybdenum disulfide, the melting speed of the film will be accelerated and the lubricating effect will be lost. Conclusions: 1) molybdenum disulfide monolayer film has excellent wear resistance and lubricity for contact load below 8 Gpa; 2) repeated friction process will bring improvement to the lubricity performance under the condition that the film is broken; 3) two-dimensional lamellar structure has an important influence on the lubricity performance of monolayer molybdenum disulfide film, high temperature and heavy load will cause damage to the film lamellar structure.

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  • 收稿日期:2022-05-09
  • 最后修改日期:2022-06-30
  • 录用日期:2022-07-07
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