Competing Structural Instabilities in the Ruddlesden–Popper Derivatives HRTiO4 (R = Rare Earths): Oxygen Octahedral Rotations Inducing Noncentrosymmetricity and Layer Sliding Retaining Centrosymmetricity

We report the observation of noncentrosymmetricity in the family of HRTiO4 (R = Eu, Gd, Dy) layered oxides possessing a Ruddlesden–Popper derivative structure, by second harmonic generation and synchrotron X-ray diffraction with the support of density functional theory calculations. These oxides wer...

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Veröffentlicht in:Chemistry of materials 2017-01, Vol.29 (2), p.656-665
Hauptverfasser: Sen Gupta, Arnab, Akamatsu, Hirofumi, Brown, Forrest G, Nguyen, Minh An T, Strayer, Megan E, Lapidus, Saul, Yoshida, Suguru, Fujita, Koji, Tanaka, Katsuhisa, Tanaka, Isao, Mallouk, Thomas E, Gopalan, Venkatraman
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Sprache:eng
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