论文标题
石墨烯增强铁复合材料的机械性能的分子动力学研究以及与基质纤维界面的空置缺陷距离的影响
A Molecular Dynamics Investigation of Mechanical Properties of Graphene Reinforced Iron Composite and The Effect of Vacancy Defect Distance from the Matrix-Fiber Interface
论文作者
论文摘要
石墨烯是具有出色机械性能的材料,它使其成为增强金属的理想纤维。由于铁是世界上最常用的金属,因此用石墨烯加固铁可以减少任何需要强度的应用中的材料的总体需求。但是,在复合材料的工业应用之前,需要知道石墨烯加固对铁的机械性能的影响。在本文中,我们通过分子动力学(MD)方法研究了石墨烯增强铁复合材料的机械性能。通过在建模的代表体积元件(RVE)上应用单轴张力来研究这些性质。还研究了温度对复合材料机械性能的影响,因为制造复合材料在较宽温度范围内的制造产品所需的知识。 MD分析还表明,断裂的启动是来自基质纤维界面的。我们还研究了空位缺陷与基质纤维界面的距离如何影响复合材料的机械性能,该特性可用于选择合适的制造过程。从这项研究中获得的结果表明,空缺缺陷在接近界面时更大程度地降低了强度。
Graphene is a material of excellent mechanical properties, which make it an ideal fiber for reinforcing metal. Since iron is the most used metal in the world, reinforcing iron with graphene can reduce the overall requirement of material in any application where strength is demanded. However, the effect of graphene reinforcement on the mechanical properties of iron needs to be known before the industrial application of the composite. In this paper, we have investigated the mechanical properties of graphene-reinforced iron composite by Molecular Dynamics (MD) method for various conditions. The properties were investigated by applying uniaxial tension on a modeled representative volume element (RVE). The effect of temperature on the mechanical property of the composite was also studied because the knowledge is required for manufacturing products with the composite operating at a wide temperature range. MD analysis also revealed that the initiation of fracture is from the matrix-fiber interface. We also investigated how the distance of vacancy defects from the matrix-fiber interface affects the mechanical properties of the composite, which can be used to select a suitable manufacturing process. The results obtained from this study show that vacancy defects lower the strength at a greater extent as it gets closer to the interface.