Suppr超能文献

重新审视用于流体动力学相互作用的悬钩子模型。II. 受限效应。

The Raspberry model for hydrodynamic interactions revisited. II. The effect of confinement.

作者信息

de Graaf Joost, Peter Toni, Fischer Lukas P, Holm Christian

机构信息

Institute for Computational Physics (ICP), University of Stuttgart, Allmandring 3, 70569 Stuttgart, Germany.

出版信息

J Chem Phys. 2015 Aug 28;143(8):084108. doi: 10.1063/1.4928503.

Abstract

The so-called "raspberry" model refers to the hybrid lattice-Boltzmann (LB) and Langevin molecular dynamics schemes for simulating the dynamics of suspensions of colloidal particles, originally developed by Lobaskin and Dünweg [New J. Phys. 6, 54 (2004)], wherein discrete surface points are used to achieve fluid-particle coupling. In this paper, we present a follow up to our study of the effectiveness of the raspberry model in reproducing hydrodynamic interactions in the Stokes regime for spheres arranged in a simple-cubic crystal [Fischer et al., J. Chem. Phys. 143, 084107 (2015)]. Here, we consider the accuracy with which the raspberry model is able to reproduce such interactions for particles confined between two parallel plates. To this end, we compare our LB simulation results to established theoretical expressions and finite-element calculations. We show that there is a discrepancy between the translational and rotational mobilities when only surface coupling points are used, as also found in Part I of our joint publication. We demonstrate that adding internal coupling points to the raspberry can be used to correct said discrepancy in confining geometries as well. Finally, we show that the raspberry model accurately reproduces hydrodynamic interactions between a spherical colloid and planar walls up to roughly one LB lattice spacing.

摘要

所谓的“树莓”模型指的是用于模拟胶体颗粒悬浮液动力学的混合格子玻尔兹曼(LB)和朗之万分子动力学方案,最初由洛巴斯金和邓韦格提出[《新物理学杂志》6, 54 (2004)],其中使用离散表面点来实现流体 - 颗粒耦合。在本文中,我们对我们关于“树莓”模型在再现简单立方晶体排列的球体在斯托克斯 regime 中的流体动力学相互作用有效性的研究进行了后续探讨[费舍尔等人,《化学物理学杂志》143, 084107 (2015)]。在这里,我们考虑“树莓”模型能够再现限制在两个平行板之间的颗粒的此类相互作用的精度。为此,我们将我们的 LB 模拟结果与既定的理论表达式和有限元计算进行比较。我们表明,仅使用表面耦合点时,平动和转动迁移率之间存在差异,这在我们联合出版物的第一部分中也有发现。我们证明,向“树莓”模型添加内部耦合点也可用于校正限制几何形状中的上述差异。最后,我们表明“树莓”模型能够准确再现球形胶体与平面壁之间的流体动力学相互作用,直至大约一个 LB 晶格间距。

文献检索

告别复杂PubMed语法,用中文像聊天一样搜索,搜遍4000万医学文献。AI智能推荐,让科研检索更轻松。

立即免费搜索

文件翻译

保留排版,准确专业,支持PDF/Word/PPT等文件格式,支持 12+语言互译。

免费翻译文档

深度研究

AI帮你快速写综述,25分钟生成高质量综述,智能提取关键信息,辅助科研写作。

立即免费体验