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形态学驱动的纳米填料尺寸测量与微机械有限元分析相结合用于量化聚合物纳米复合材料中的界面相

Morphology-Driven Nanofiller Size Measurement Integrated with Micromechanical Finite Element Analysis for Quantifying Interphase in Polymer Nanocomposites.

作者信息

Mohsenzadeh Rasool, Soudmand Behzad Hashemi, Najafi Amirhossein, Hazzazi Fawwaz

机构信息

Department of Mechanical Engineering, Technical and Vocational University (TVU), Tehran 1435761137, Iran.

Department of Mechanical Engineering, Gebze Technical University, Kocaeli 41400, Turkey.

出版信息

ACS Appl Mater Interfaces. 2024 Jul 31;16(30):39927-39941. doi: 10.1021/acsami.4c02797. Epub 2024 Jul 17.

DOI:10.1021/acsami.4c02797
PMID:39018426
Abstract

This study focused on an innovative practical method using computer vision for particle size measurement, which serves as a key precursor for predicting the elastic modulus of polymer nanocomposites. This approach involved the morphological segmentation of the nanodispersed phase. It aimed, for the first time, to address the impractical conditions resulting from the assumption of idealized single-particle sizes in a monodispersed system during modeling. Subsequently, a micromechanical finite element framework was employed to determine the interphase thickness and modulus in ultrahigh molecular weight polyethylene/nanozeolite composites, following the quantification of nanoparticle sizes. The size measurement approach relied on morphological images extracted from scanning electron microscopy micrographs of impact-fractured surfaces. To compute the interphase thickness, experimental data was fitted to an interphase-inclusive upper-bound Hashin-Shtrikman model, with the measured average particle size per composition serving as a crucial input. Subsequently, the interphase elastic modulus was computed based on its thickness, employing a hybrid modified-Hashin-Hansen and Maxwell model. These estimated interfacial variables were then utilized as inputs for the finite element model to determine the tensile modulus. A comparison between the model results and measured data revealed a maximum discrepancy of 3.29%, indicating the effectiveness of the methodology employed in quantifying interfacial properties.

摘要

本研究聚焦于一种利用计算机视觉进行粒度测量的创新实用方法,这是预测聚合物纳米复合材料弹性模量的关键前提。该方法涉及纳米分散相的形态分割。它首次旨在解决建模过程中因假设单分散体系中理想化单颗粒尺寸而产生的不切实际情况。随后,在对纳米颗粒尺寸进行量化之后,采用微观力学有限元框架来确定超高分子量聚乙烯/纳米沸石复合材料的界面厚度和模量。尺寸测量方法依赖于从冲击断裂表面的扫描电子显微镜显微照片中提取的形态图像。为了计算界面厚度,将实验数据拟合到包含界面的上限Hashin-Shtrikman模型,每个组合物的测量平均颗粒尺寸作为关键输入。随后,基于其厚度,采用混合修正-Hashin-Hansen和Maxwell模型计算界面弹性模量。然后将这些估计的界面变量用作有限元模型的输入来确定拉伸模量。模型结果与测量数据之间的比较显示最大差异为3.29%,表明所采用的方法在量化界面性质方面的有效性。

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