由小团簇尺寸分布估计二维胶体晶体的边缘自由能

IF 2.6 3区 化学 Q2 CHEMISTRY, MULTIDISCIPLINARY
CrystEngComm Pub Date : 2025-06-24 DOI:10.1039/D5CE00523J
Masahide Sato, Hiroyasu Katsuno, Keigo Kishida and Yoshihisa Suzuki
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引用次数: 0

摘要

在许多材料系统中,直接观察凝固过程的基本过程是具有挑战性的。这些困难阻碍了对临界成核尺寸和成核速率的准确估计。然而,在胶体体系中,大颗粒尺寸和缓慢的颗粒动力学使得可以直接观察基本过程,如成核。我们通过光学显微镜观察二维胶体团簇的形成,并将机器学习应用于小团簇以确定团簇大小分布。我们估计了二维岛屿的边缘自由能。布朗动力学模拟也得到了类似的结果。从模拟中估计的边缘自由能与从键计数模型中预期的大小相同。因此,我们认为实验系统中粒子之间的相互作用能可以由观察到的边缘能量来估计。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Edge free energy of a 2D colloidal crystal estimated from the size distribution of small clusters†

Edge free energy of a 2D colloidal crystal estimated from the size distribution of small clusters†

Direct observation of elementary processes during solidification is challenging in many material systems. Such difficulties hinder accurate estimation of critical nucleation size and nucleation rate. However, in colloidal systems, the large particle size and slow particle dynamics enable direct observation of elementary processes such as nucleation. We observed the formation of two-dimensional colloidal clusters by optical microscopy and applied machine learning to small clusters to determine the cluster size distribution. We estimated the edge free energy for two-dimensional islands. Brownian dynamics simulations were also performed, which obtained similar results. The edge free energy estimated from the simulations has the same magnitude as expected from a bond-counting model. Thus, we suggest that the interaction energy between particles in an experimental system can be estimated from the observed edge energy.

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来源期刊
CrystEngComm
CrystEngComm 化学-化学综合
CiteScore
5.50
自引率
9.70%
发文量
747
审稿时长
1.7 months
期刊介绍: Design and understanding of solid-state and crystalline materials
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