Dynamics of rotating paramagnetic particles simulated by lattice Boltzmann and particle dynamics methods.

A Yadav, R Calhoun, P E Phelan, A K Vuppu, A A Garcia, M Hayes
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引用次数: 8

Abstract

Novel biochemical sensors consisting of rotating chains of microscale paramagnetic particles have been proposed that would enable convenient, sensitive analyte detection. Predicting the dynamics of these particles is required to optimise their design. The results of lattice Boltzmann (LB) and particle dynamics (PD) simulations are reported, where the LB approach provides a verified solution of the complete Navier-Stokes equations, including the hydrodynamic interactions among the particles. On the other hand, the simpler PD approach neglects hydrodynamic interactions, and does not compute the fluid motion. It is shown that macroscopic properties, like the number of aggregated particles, depend only on the drag force and not on the total hydrodynamic force, making PD simulations yield reasonably accurate predictions. Relatively good agreement between the LB and PD simulations, and qualitative agreement with experimental data, are found for the number of aggregated particles as a function of the Mason number. The drag force on a rotating cylinder is significantly different from that on particle chains calculated from both simulations, demonstrating the different dynamics between the two cases. For microscopic quantities like the detailed force distributions on each particle, the complete Navier-Stokes solution, here represented by the LB simulation, is required.

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用晶格玻尔兹曼和粒子动力学方法模拟旋转顺磁粒子动力学。
新型生化传感器由微尺度顺磁颗粒的旋转链组成,可实现方便、灵敏的分析物检测。预测这些粒子的动力学是优化它们的设计所必需的。本文报道了晶格玻尔兹曼(LB)和粒子动力学(PD)模拟的结果,其中LB方法提供了完整的Navier-Stokes方程的验证解,包括粒子之间的流体动力学相互作用。另一方面,简单的PD方法忽略了流体动力相互作用,并且不计算流体运动。结果表明,宏观性质,如聚集粒子的数量,只取决于阻力而不取决于总水动力,使得PD模拟产生相当准确的预测。LB和PD模拟之间的一致性相对较好,并且与实验数据的定性一致,发现聚集粒子的数量作为梅森数的函数。在两种情况下,旋转圆柱体上的阻力与粒子链上的阻力存在显著差异,表明了两种情况下的动力学差异。对于像每个粒子上的详细力分布这样的微观量,需要完整的Navier-Stokes解,这里用LB模拟表示。
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