Structure–Curie temperature relationships in BaTiO 3 -based ferroelectric perovskites: Anomalous behavior of ( Ba , Cd ) TiO 3 from DFT, statistical inference, and experiments

Balachandran, Prasanna V.; Xue, Dezhen; Lookman, Turab

doi:10.1103/PhysRevB.93.144111

Title: Structure–Curie temperature relationships in ${BaTiO}_{3}$ -based ferroelectric perovskites: Anomalous behavior of $(Ba, Cd) {TiO}_{3}$ from DFT, statistical inference, and experiments

Journal Article · Mon Apr 11 00:00:00 EDT 2016 · Physical Review B

DOI:https://doi.org/10.1103/PhysRevB.93.144111· OSTI ID:1246755

Balachandran, Prasanna V.; Xue, Dezhen; Lookman, Turab

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Sponsoring Organization:: USDOE

Grant/Contract Number:: 20140013DR

OSTI ID:: 1246755

Journal Information:: Physical Review B, Journal Name: Physical Review B Vol. 93 Journal Issue: 14; ISSN 2469-9950

Publisher:: American Physical SocietyCopyright Statement

Country of Publication:: United States

Language:: English

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Title: Structure–Curie temperature relationships in ${BaTiO}_{3}$ -based ferroelectric perovskites: Anomalous behavior of $(Ba, Cd) {TiO}_{3}$ from DFT, statistical inference, and experiments