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hopping 行为介导了纳米颗粒在多孔水凝胶中的异常受限扩散。

Hopping Behavior Mediates the Anomalous Confined Diffusion of Nanoparticles in Porous Hydrogels.

机构信息

State Key Laboratory of Nonlinear Mechanics, Beijing Key Laboratory of Engineered Construction and Mechanobiology, Institute of Mechanics, Chinese Academy of Sciences, Beijing100190, China.

School of Optoelectronic Engineering and Instrumentation Science, Dalian University of Technology, Dalian116024, China.

出版信息

J Phys Chem Lett. 2022 Nov 17;13(45):10612-10620. doi: 10.1021/acs.jpclett.2c02733. Epub 2022 Nov 9.

Abstract

Diffusion is an essential means of mass transport in porous materials such as hydrogels, which are appealing in various biomedical applications. Herein, we investigate the diffusive motion of nanoparticles (NPs) in porous hydrogels to provide a microscopic view of confined diffusion. Based on the mean square displacement from particle tracking experiments, we elucidate the anomalous diffusion dynamics of the embedded NPs and reveal the heterogeneous pore structures in hydrogels. The results demonstrate that diffusive NPs can intermittently escape from single pores through void connective pathways and exhibit non-Gaussian displacement probability distribution. We simulate this scenario using the Monte Carlo method and clarify the existence of hopping events in porous diffusion. The resultant anomalous diffusion can be fully depicted by combining the hopping mechanism and the hydrodynamic effect. Our results highlight the hopping behavior through the connective pathways and establish a hybrid model to predict NP transport in porous environments.

摘要

扩散是多孔材料(如水凝胶)中物质传输的一种重要方式,水凝胶在各种生物医学应用中具有吸引力。在此,我们研究了纳米粒子(NPs)在多孔水凝胶中的扩散运动,以提供受限扩散的微观视角。基于从粒子追踪实验得到的均方位移,我们阐明了嵌入 NPs 的异常扩散动力学,并揭示了水凝胶中的非均相孔结构。结果表明,扩散的 NPs 可以通过空隙连通途径间歇性地从单个孔中逃逸,并表现出非高斯位移概率分布。我们使用蒙特卡罗方法对此情况进行模拟,并阐明了多孔扩散中的跳跃事件的存在。通过结合跳跃机制和流体力学效应,可以完全描述这种异常扩散。我们的结果突出了通过连通途径的跳跃行为,并建立了一个混合模型来预测 NP 在多孔环境中的传输。

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