1. Interatomic potentials for oxide glasses: Past, present, and future
- Author
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Alfonso Pedone, Marco Bertani, Luca Brugnoli, and Annalisa Pallini
- Subjects
Molecular dynamics simulations ,Interatomic potentials ,Oxide glasses ,Structure ,Properties ,Materials of engineering and construction. Mechanics of materials ,TA401-492 ,Chemistry ,QD1-999 - Abstract
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.
- Published
- 2022
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