Borker Neeraj Sinai
Independent Researcher, St Paul, Minnesota 55101, United States.
Langmuir. 2024 Oct 8;40(40):20872-20887. doi: 10.1021/acs.langmuir.4c01130. Epub 2024 Sep 25.
An ideal collision rate (ICR) is defined as the average rate of contact between two particles that translate and rotate with the imposed fluid flow in the absence of interparticle interactions. ICR in a simple shear flow provides an estimate of the collision rate in a flowing dilute particle suspension, and its value is known only for traditional convex shapes such as spheres and cylinders. In this work, we compute the ICR for a family of (shown in Figure 1) that are particles composed of three orthogonal cylinders with coinciding centers (forming six arms) with at least two cylinders having the same length. We employed the finite-element method to obtain the rotational dynamics of hexapods and Monte Carlo simulations to calculate their ICR. Our results indicate that the ICR for hexapods is not directly proportional to the volume of the particle, in contrast to what is observed for convex shapes such as spheres and cylinders. For hexapods of the same size, the ICR could be similar for particles with order-of-magnitude differences in their volumes and it could also vary by an order of magnitude for particles with similar volumes. Specifically for hexapods termed branched fibers, which have one longer cylinder, the ICR changes by an order of magnitude even when the shorter cylinders are significantly smaller than the longer cylinder. This change is attributed to the increase in the tumbling frequency of the particle due to hydrodynamic forces acting on the shorter arms, in addition to the increased probability of collision afforded by them. Using asymptotic theory for high-aspect ratio cylinders, we showed that the tumbling period of hexapods was proportional to an algebraic power of the ratio of its arm lengths and has a weaker logarithm relationship with the aspect ratio of its arms. The collision cross-section provided the relative cross-streamline particle separations for the most likely binary collisions in the suspensions, and its value was sensitive to the arm lengths, as well. The collision rate of hexapods also could not be estimated within an order of magnitude from existing geometric models, such as the ICR of a circumscribing convex shape, ICR for one of the individual cylinders of the hexapod, or using the particle volume times the shear rate. Our work indicates that collision rate for non-convex particles in shear flows critically depends on the shape of the particle due to nontrivial changes in the particle's orientational dynamics, and the ICR calculation serves as a more reliable method for estimating their true collision rates in the suspension.
理想碰撞率(ICR)定义为在不存在颗粒间相互作用的情况下,随外加流体流动进行平移和旋转的两个颗粒之间的平均接触率。简单剪切流中的ICR可估算流动稀颗粒悬浮液中的碰撞率,其值仅针对诸如球体和圆柱体等传统凸形已知。在这项工作中,我们计算了一族(如图1所示)的ICR,这些颗粒由三个中心重合的正交圆柱体组成(形成六条臂),且至少有两个圆柱体长度相同。我们采用有限元方法来获得六足体的旋转动力学,并通过蒙特卡罗模拟来计算它们的ICR。我们的结果表明,与球体和圆柱体等凸形不同,六足体的ICR与颗粒体积不成正比。对于相同尺寸的六足体,体积相差一个数量级的颗粒其ICR可能相似,而体积相似的颗粒其ICR也可能相差一个数量级。具体对于称为分支纤维的六足体,其有一个较长的圆柱体,即使较短的圆柱体比长圆柱体小得多,ICR也会变化一个数量级。这种变化归因于作用在较短臂上的流体动力导致颗粒翻滚频率增加,以及它们提供的碰撞概率增加。利用高纵横比圆柱体的渐近理论,我们表明六足体的翻滚周期与臂长比的代数幂成正比,并且与臂的纵横比具有较弱的对数关系。碰撞横截面给出了悬浮液中最可能的二元碰撞的相对跨流线颗粒间距,其值对臂长也很敏感。六足体的碰撞率也无法从现有几何模型中估算出一个数量级,例如外接凸形的ICR、六足体单个圆柱体之一的ICR,或者使用颗粒体积乘以剪切率。我们的工作表明,剪切流中非凸颗粒的碰撞率由于颗粒取向动力学的非平凡变化而严重依赖于颗粒形状,并且ICR计算是估算它们在悬浮液中真实碰撞率的更可靠方法。