Particle elongation is an important factor affecting the packing properties of rod-like particles. However, rod-like particles can be easily bent into non-convex shapes, in which the effect of bending should also be o...Particle elongation is an important factor affecting the packing properties of rod-like particles. However, rod-like particles can be easily bent into non-convex shapes, in which the effect of bending should also be of concerned, To explore the shape effects of elongation and bending, together with the size and volume fraction effects on the disordered packing density of mixtures of non-convex particles, binary and polydisperse mixtures of curved spherocylinders are simulated employing sphere assembly models and the relaxation algorithm in the present work. For binary packings with the same volume, curves of the packing density versus volume fraction have good linearity, while densities are plotted as a series of equidistant curves under the condition of the same shape. The independence of size and shape effects on the packing density is verified for mixtures of curved spherocylinders. The explicit formula used to predict the density of binary mixtures, by superposing the two independent functions of the size and shape parameters, is extended to include a non-convex shape factor. A polydisperse packing with the shape factor following a uniform distribution under the condition of the same volume is equivalent to a binary mixture with certain components. The packing density is thus predicted as the mean of maximum and minimum densities employing a weighing method.展开更多
Mixtures of binary spheres are numerically simulated using a relaxation algorithm to investigate the effects of volume fraction and size ratio, A complete profile of the packing properties of binary spheres is given. ...Mixtures of binary spheres are numerically simulated using a relaxation algorithm to investigate the effects of volume fraction and size ratio, A complete profile of the packing properties of binary spheres is given. The density curve with respect to the volume fraction has a triangular shape with a peak at 70% large spheres. The density of the mixture increases with the size ratio, but the growth becomes slow in the case of a large size disparity, The volume fraction and size ratio effects are reflected in the height and movement, respectively, of specific peaks in the radial distribution functions. The structure of the mixture is further analyzed in terms of contact types, and the mean coordination number is demonstrated to be primarily affected by "large-small" contacts. A novel method for estimating the average relative excluded volume for binary spheres by weighting the percentages of contact types is proposed and extended to polydisperse packings of certain size distributions. The method can be applied to explain the density trends of polydisperse mixtures in disordered sphere systems,展开更多
基金This work was supported by the National Natural Science Foundation of China (Grant Nos. 11272010, 11572004 and 11602088). Tile China Postdoctoral Science Foundation (Grant No. 2016M592484) is also acknowledged.
文摘Particle elongation is an important factor affecting the packing properties of rod-like particles. However, rod-like particles can be easily bent into non-convex shapes, in which the effect of bending should also be of concerned, To explore the shape effects of elongation and bending, together with the size and volume fraction effects on the disordered packing density of mixtures of non-convex particles, binary and polydisperse mixtures of curved spherocylinders are simulated employing sphere assembly models and the relaxation algorithm in the present work. For binary packings with the same volume, curves of the packing density versus volume fraction have good linearity, while densities are plotted as a series of equidistant curves under the condition of the same shape. The independence of size and shape effects on the packing density is verified for mixtures of curved spherocylinders. The explicit formula used to predict the density of binary mixtures, by superposing the two independent functions of the size and shape parameters, is extended to include a non-convex shape factor. A polydisperse packing with the shape factor following a uniform distribution under the condition of the same volume is equivalent to a binary mixture with certain components. The packing density is thus predicted as the mean of maximum and minimum densities employing a weighing method.
基金supported by the National Natural Science Foundation of China(Grant No.11272010)the National Basic Research Program of China(Grant No.2010CB832701)
文摘Mixtures of binary spheres are numerically simulated using a relaxation algorithm to investigate the effects of volume fraction and size ratio, A complete profile of the packing properties of binary spheres is given. The density curve with respect to the volume fraction has a triangular shape with a peak at 70% large spheres. The density of the mixture increases with the size ratio, but the growth becomes slow in the case of a large size disparity, The volume fraction and size ratio effects are reflected in the height and movement, respectively, of specific peaks in the radial distribution functions. The structure of the mixture is further analyzed in terms of contact types, and the mean coordination number is demonstrated to be primarily affected by "large-small" contacts. A novel method for estimating the average relative excluded volume for binary spheres by weighting the percentages of contact types is proposed and extended to polydisperse packings of certain size distributions. The method can be applied to explain the density trends of polydisperse mixtures in disordered sphere systems,