氧化玻璃的原子间电位:过去、现在和未来

Q1 Physics and Astronomy
Alfonso Pedone, Marco Bertani, Luca Brugnoli, Annalisa Pallini
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引用次数: 2

摘要

氧化玻璃原子间电势模型的不断发展和完善,使经典分子动力学成为一种强大的计算技术,可与更先进的实验技术相媲美,经常用于研究这种材料的结构和性能。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Interatomic potentials for oxide glasses: Past, present, and future

The continuous development and improvement of interatomic potential models for oxide glasses have made classical molecular dynamics a powerful computational technique routinely used for studying the structure and properties of such materials on a par with the more advanced experimental techniques.

In this brief review, we retrace the development of the most used interatomic potential models from the earliest MD simulations up to now with a look at the possible future developments in this field due to the advent of the machine learning era and data-driven methods.

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来源期刊
Journal of Non-Crystalline Solids: X
Journal of Non-Crystalline Solids: X Materials Science-Materials Chemistry
CiteScore
3.20
自引率
0.00%
发文量
50
审稿时长
76 days
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