Configurational Entropy Relaxation of Silica Glass—Molecular Dynamics Simulations
Vitreous silica was modelled using molecular dynamics (MD). The glass structure was transferred into an undirected graph and decomposed into disjoint structural units that were ideally mixed to calculate the configurational entropy. The Debye relaxation model was suggested to simulate the evolution...
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| Format: | Article |
| Language: | English |
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MDPI AG
2021-07-01
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| Series: | Entropy |
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| Online Access: | https://www.mdpi.com/1099-4300/23/7/885 |