由键能和晶格数据得到的内部成核倾向和晶体表面能

Q1 Physics and Astronomy Journal of Non-Crystalline Solids: X Pub Date : 2022-06-01 DOI:10.1016/j.nocx.2022.100093

C. Tielemann , S. Reinsch , R. Maaß , J. Deubener , R. Müller

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引用次数: 4

摘要

我们提出了一种易于应用的方法来预测氧化玻璃内部成核趋势的结构趋势。该方法基于易于获取的双原子键能和晶格数据计算出的晶体断裂表面能。用氧化物玻璃等化学结晶的文献成核数据证明了该方法的适用性。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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Internal nucleation tendency and crystal surface energy obtained from bond energies and crystal lattice data

We present an easy-to-apply method to predict structural trends in the internal nucleation tendency of oxide glasses. The approach is based on calculated crystal fracture surface energies derived from easily accessible diatomic bond energy and crystal lattice data. The applicability of the method is demonstrated on literature nucleation data for isochemically crystallizing oxide glasses.

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