Candidate ferroelectrics via ab initio high-throughput screening of polar materials
Abstract Ferroelectrics are a class of polar and switchable functional materials with diverse applications, from microelectronics to energy conversion. Computational searches for new ferroelectric materials have been constrained by accurate prediction of the polarization and switchability with elect...
Main Authors: | Francesco Ricci, Sebastian E. Reyes-Lillo, Stephanie A. Mack, Jeffrey B. Neaton |
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Format: | Article |
Language: | English |
Published: |
Nature Portfolio
2024-01-01
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Series: | npj Computational Materials |
Online Access: | https://doi.org/10.1038/s41524-023-01193-3 |
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