Extensive experiments have shown that materials with heterogeneous microstructures comprising grains with different sizes that span over at least one order of magnitude, such as the gradient and bimodal nano-grained metals, have lower coefficient of friction and wear loss. However, the deformation mechanism of the enhanced frictional performance remains unclear because of the complex grain microstructure. Here, a finite element model has been established to investigate the deformation of a bimodal structured Cu during scratch test. Our simulations show that the bimodal nanostructures can achieve a coefficient of friction (COF) as low as 0.399, which is 11% lower than the smallest COF of the homogeneous coarse-grained or nano-grained Cu, i.e., 0.446. The lowest COF of the bimodal nanostructure is achieved by decreasing the hard domain grain size and increasing the soft domain grain size and volume fraction. The reduced COF is revealed to arise from the heterogeneity of the bimodal nanostructure, which can effectively restrain the strain localization, leading to the decrease of the contact depth during the scratch process. Our calculations also show that the bimodal nanostructures possess a much better balance of high strength and low COF than the gradient ones.
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