Journal of Non-Crystalline Solids: X (Dec 2019)

Machine learning for glass science and engineering: A review

  • Han Liu,
  • Zipeng Fu,
  • Kai Yang,
  • Xinyi Xu,
  • Mathieu Bauchy

Journal volume & issue
Vol. 4

Abstract

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The design of new glasses is often plagued by poorly efficient Edisonian “trial-and-error” discovery approaches. As an alternative route, the Materials Genome Initiative has largely popularized new approaches relying on artificial intelligence and machine learning for accelerating the discovery and optimization of novel, advanced materials. Here, we review some recent progress in adopting machine learning to accelerate the design of new glasses with tailored properties. Keywords: Composition-property relationship, Structural signature, Molecular dynamics simulation, Artificial neuron network, Bayesian optimization