Tuning between Proper and Hybrid-Improper Mechanisms for Polar Behavior in CsLn2Ti2NbO10 Dion-Jacobson Phases.

作者: Vanessa A Cascos , Jennifer Roberts-Watts , Chloe Skingle , Igor Levin , Weiguo Zhang

DOI: 10.1021/ACS.CHEMMATER.0C03326

关键词: NeutronMaterials scienceEnergy landscapeDensity functional theoryElectron diffractionFerroelectricityPolarChemical physicsPoint reflection

摘要: … Alternatively, hybrid-improper mechanisms for ferroelectricity … C for 12 h) pellets followed by ion polishing at 100 K until … We also note that the X 3 + and R 3 + modes (more complex …

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