论文标题
眼镜的拓扑约束理论和刚性
Topological Constraint Theory and Rigidity of Glasses
论文作者
论文摘要
拓扑约束理论已成为一种越来越流行的工具,可以预测玻璃特性的组成依赖性或通过量身定制的功能来确定有希望的成分。这种方法将复杂的无序网络减少到更简单的机械桁架中。因此,拓扑约束理论捕获了控制宏观特性的重要原子拓扑,同时滤除了较少相关的二阶结构细节。因此,拓扑约束理论可以用来解码玻璃的基因组,即识别和破译基本的玻璃基本结构构建块如何以与人类基因组提供的信息相同的方式来控制其工程性能,以作为个人的成长和发展的蓝图。由于其优雅和简单性,拓扑约束理论使基于物理学的模型的开发能够在分析上预测玻璃的各种特性。在本章中,我介绍了玻璃科学的一些一般背景,原子刚性的概念和拓扑约束理论。对各种原型眼镜提出了拓扑约束方案,用于了解其玻璃形成能力的起源。最后,回顾了能够预测玻璃性能的各种拓扑模型,重点是硬度,断裂韧性,粘度,脆弱性,玻璃过渡温度和溶解动力学。
Topological constraint theory has become an increasingly popular tool to predict the compositional dependence of glass properties or pinpoint promising compositions with tailored functionalities. This approach reduces complex disordered networks into simpler mechanical trusses. Thereby, topological constraint theory captures the important atomic topology that controls macroscopic properties while filtering out less relevant second-order structural details. As such, topological constraint theory can be used to decode the genome of glass, that is, to identify and decipher how the basic structural building blocks of glasses control their engineering properties---in the same way as the human genome offers information that serves as a blueprint for an individual's growth and development. Thanks to its elegance and simplicity, topological constraint theory has enabled the development of various physics-based models that can analytically predict various properties of glass. In this Chapter, I introduce some general background in glass science, concepts of atomic rigidity, and topological constraint theory. The topological constraints enumeration scheme is presented for various archetypical glasses and is used to understand the origin of their glass-forming ability. Finally, various topological models enabling the prediction of glass properties are reviewed, with a focus on hardness, fracture toughness, viscosity, fragility, glass transition temperature, and dissolution kinetics.