Jiao Y, Stillinger F H, Torquato S
Department of Mechanical and Aerospace Engineering, Princeton University, Princeton, New Jersey 08544, USA.
Phys Rev E Stat Nonlin Soft Matter Phys. 2010 Apr;81(4 Pt 1):041304. doi: 10.1103/PhysRevE.81.041304. Epub 2010 Apr 15.
Dense random packings of hard particles are useful models of granular media and are closely related to the structure of nonequilibrium low-temperature amorphous phases of matter. Most work has been done for random jammed packings of spheres and it is only recently that corresponding packings of nonspherical particles (e.g., ellipsoids) have received attention. Here we report a study of the maximally random jammed (MRJ) packings of binary superdisks and monodispersed superballs whose shapes are defined by |x1|2p+...+|xd|2p<or=1 with d=2 and 3, respectively, where p is the deformation parameter with values in the interval (0,infinity). As p increases from zero, one can get a family of both concave (0<p<0.5) and convex (p>or=0.5) particles with square symmetry (d=2), or octahedral and cubic symmetry (d=3). In particular, for p=1 the particle is a perfect sphere (circular disk) and for p-->infinity the particle is a perfect cube (square). We find that the MRJ densities of such packings increase dramatically and nonanalytically as one moves away from the circular-disk and sphere point (p=1). Moreover, the disordered packings are hypostatic, i.e., the average number of contacting neighbors is less than twice the total number of degrees of freedom per particle, and yet the packings are mechanically stable. As a result, the local arrangements of particles are necessarily nontrivially correlated to achieve jamming. We term such correlated structures "nongeneric." The degree of "nongenericity" of the packings is quantitatively characterized by determining the fraction of local coordination structures in which the central particles have fewer contacting neighbors than average. We also show that such seemingly "special" packing configurations are counterintuitively not rare. As the anisotropy of the particles increases, the fraction of rattlers decreases while the minimal orientational order as measured by the tetratic and cubatic order parameters increases. These characteristics result from the unique manner in which superballs break their rotational symmetry, which also makes the superdisk and superball packings distinctly different from other known nonspherical hard-particle packings.
硬颗粒的致密随机堆积是颗粒介质的有用模型,并且与非平衡低温无定形相物质的结构密切相关。大多数工作是针对球体的随机堵塞堆积开展的,直到最近非球形颗粒(例如椭球体)的相应堆积才受到关注。在此,我们报告了一项关于二元超圆盘和单分散超球的最大随机堵塞(MRJ)堆积的研究,其形状分别由|x1|2p +... + |xd|2p≤1定义,其中d = 2和3,这里p是变形参数,取值范围为(0,∞)。随着p从零增加,对于二维情况可以得到一族具有方形对称性的凹形(0 < p < 0.5)和凸形(p≥0.5)颗粒,对于三维情况可以得到具有八面体和立方对称性的颗粒。特别地,当p = 1时颗粒是完美球体(圆形盘),当p→∞时颗粒是完美立方体(正方形)。我们发现,当远离圆形盘和球体点(p = 1)时,此类堆积的MRJ密度急剧且非解析地增加。此外,无序堆积是静定的,即平均接触邻居数小于每个颗粒总自由度的两倍,然而堆积却是机械稳定的。因此,颗粒的局部排列必然存在非平凡的相关性以实现堵塞。我们将这种相关结构称为“非一般的”。通过确定中心颗粒接触邻居数少于平均值的局部配位结构的比例,定量地表征了堆积的“非一般性”程度。我们还表明,这种看似“特殊”的堆积构型出乎意料地并不罕见。随着颗粒各向异性增加,游动体的比例降低,而由四次和三次序参数测量的最小取向有序度增加。这些特征源于超球打破其旋转对称性的独特方式,这也使得超圆盘和超球堆积与其他已知的非球形硬颗粒堆积明显不同。