Computational Modeling of Silicate Glasses: A Quantitative Structure-Property Relationship Perspective
作者： Alfonso Pedone , Maria Cristina Menziani
DOI: 10.1007/978-3-319-15675-0_5
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摘要: This article reviews the present state of Quantitative Structure-Property Relationships (QSPR) in glass design and gives an outlook into future developments. First overview is given statistical methodology, with particular emphasis to integration QSPR molecular dynamics simulations derive informative structural descriptors. Then, potentiality this approach as a tool for interpretative predictive purposes highlighted by number recent inspiring applications.
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