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胶体系统中具有粗糙表面形态的可变形固体和空心颗粒的相互作用。

Interaction of deformable solid and hollow particles with rough surface morphology in colloidal systems.

机构信息

Green Processes Research Centre and Chemical Engineering Department, Lakehead University, 955 Oliver Road, Thunder Bay, ON P7B5E1, Canada.

Green Processes Research Centre and Chemical Engineering Department, Lakehead University, 955 Oliver Road, Thunder Bay, ON P7B5E1, Canada.

出版信息

J Colloid Interface Sci. 2023 Jan 15;630(Pt B):497-510. doi: 10.1016/j.jcis.2022.10.070. Epub 2022 Oct 23.

Abstract

HYPOTHESIS AND BACKGROUND

A majority of natural particles have deformable and rough surfaces. Past research indicated a lack of information for a numerical model to simulate the potential non-contact interaction between two deformable particles with uneven surfaces. The simulation of deformable particles is critical to better understanding the interaction of deformable particles in colloidal systems. We hypothesized that numerical models could simulate the deformation process of solid and hollow particles, and the constructed models could predict the impact of deformation on the interaction of rough-surfaced solid or hollow deformable particles.

NUMERICAL MODELING

This work modeled the deformable solid and hollow particles with rough surface morphologies following a fractal geometry theory. Their non-contact interaction was simulated following the three-stages deformation model. Also, the impacts of surface tension, particle size, and surface roughness on the interaction of the particles were investigated.

FINDINGS

It was observed that the total potential energy of deformable solid and hollow particles followed a similar pattern under different conditions. The difference in the energy profile between solid and hollow particles is that the hollow particles generate a deeper primary minimum, and the energy barrier disappears, indicating that the hollow particles have better attachment affinity. The results show that the increased particle size will strengthen the deformability of deformable solid and hollow particles and their potential interaction, and particle size will be the most influential parameter in affecting the deformability of particles. When the particle size increased from 10 nm to 1000 nm, the deformation region of solid particles was enlarged from 5 nm to 90 nm. Nevertheless, increased surface tension would weaken the deformability of deformable solid and hollow particles, which would significantly reduce particle aggregation. The increase in the fractal dimension would reduce solid and hollow particles' deformability but increase the potential interaction energy. The controversial results could be found by increasing fractal roughness, which would improve the deformability of particles and reduce the interaction energy. The results of this study could be applied for foreseeing the deformation and interaction of deformable particles with potential applications in suspension systems, such as biological cell suspensions.

摘要

假设和背景

大多数自然粒子都具有可变形和粗糙的表面。过去的研究表明,缺乏数值模型来模拟两个具有不均匀表面的可变形粒子之间潜在的非接触相互作用的信息。可变形粒子的模拟对于更好地理解胶体系统中可变形粒子的相互作用至关重要。我们假设数值模型可以模拟固体和空心粒子的变形过程,并且构建的模型可以预测变形对粗糙表面固体或空心可变形粒子相互作用的影响。

数值建模

这项工作采用分形几何理论对具有粗糙表面形态的可变形固体和空心粒子进行建模。它们的非接触相互作用是按照三阶段变形模型进行模拟的。此外,还研究了表面张力、颗粒尺寸和表面粗糙度对颗粒相互作用的影响。

结果

观察到在不同条件下,可变形固体和空心粒子的总势能遵循相似的模式。固体和空心粒子之间能量分布的差异在于,空心粒子产生更深的初级最小势能,且能垒消失,这表明空心粒子具有更好的附着亲和力。结果表明,增加颗粒尺寸会增强可变形固体和空心粒子的可变形性及其潜在的相互作用,且颗粒尺寸是影响粒子可变形性的最具影响力的参数。当颗粒尺寸从 10nm 增加到 1000nm 时,固体粒子的变形区域从 5nm 扩大到 90nm。然而,增加表面张力会削弱可变形固体和空心粒子的可变形性,从而显著减少颗粒聚集。分形维数的增加会降低固体和空心粒子的可变形性,但会增加潜在的相互作用能。增加分形粗糙度会产生相反的结果,这会提高粒子的可变形性并降低相互作用能。这项研究的结果可应用于预测具有潜在应用于悬浮系统(如生物细胞悬浮液)的可变形粒子的变形和相互作用。

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