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Accelerated search for BaTiO3-based piezoelectrics with vertical morphotropic phase boundary using Bayesian learning

D. Xue,P. Balachandran,4 Authors,T. Lookman

2016 · DOI: 10.1073/pnas.1607412113
Proceedings of the National Academy of Sciences of the United States of America · 128 Citations

TLDR

This work combines informatics and materials knowledge using results from Landau–Devonshire theory to guide experiments in the design of lead-free piezoelectrics with desired properties, and predicts, synthesize, and characterize a solid solution that shows better temperature reliability than other BaTiO3-based piezOElectrics in initial training data.