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Order-Disorder Phenomena and Octahedral Tilting in SrTi1-XSnXO3 Perovskites – A Structural and Spectroscopic Study
Journal of Solid State Chemistry ( IF 3.2 ) Pub Date : 2018-10-14 , DOI: 10.1016/j.jssc.2018.10.006
Anderson B.S. Lavinscky , Anna-Maria Welsch , Brendan J. Kennedy , Maria I.B. Bernardi , Valmor R. Mastelaro

Oxides of the type SrTi1-xSnxO3 have been prepared using both a solid state and polymeric precursor method and characterized using high-resolution Synchrotron X-ray Diffraction and X-ray Absorption and Raman spectroscopies. The diffraction measurements demonstrate that a continuous pseudo-solid solution exists between the cubic SrTiO3 and orthorhombic SrSnO3 end-members with the same sequence of structures cubic Pm3̅m → tetragonal I4/mcm → orthorhombic Imma → orthorhombic Pnma being observed irrespective of the preparation method. The Raman and XAS measurements revealed the presence of extensive disorder in samples treated at low temperatures, and that this disorder is reduced, but not totally eliminated, by annealing above 1300 °C. It is likely the local structure evolves similarly to that established by S-XRD for samples annealed above 1300 °C. This postulate is supported by the Ti K-edge XANES measurements that showed the local symmetry of the Ti cation evolves systematically as Sn4+ ions replace the Ti4+cations in the samples, irrespective of the temperature to which the sample had been heated.



中文翻译:

SrTi 1-X Sn X O 3钙钛矿中的无序现象和八面体倾斜–结构和光谱研究

已经使用固态和聚合物前体方法制备了SrTi 1-x Sn x O 3类型的氧化物,并使用高分辨率的同步加速器X射线衍射和X射线吸收和拉曼光谱学对其进行了表征。衍射测量结果表明,在立方SrTiO 3和正交晶体SrSnO 3末端成员之间存在连续的拟固溶体,具有相同的立方结构顺序下午3̅→与制备方法无关,观察到四方晶系I 4 / mcm →斜方晶系Imma →斜方晶系Pnma。拉曼和XAS测量表明,在低温条件下处理的样品中存在广泛的无序现象,通过在1300  °C以上退火,这种无序现象得以缓解,但并未完全消除。对于1300  °C以上退火的样品,其局部结构可能与S-XRD建立的结构相似。Ti K-edge XANES测量结果支持了这一假设,该测量结果表明,随着Sn 4+离子替代Ti 4+的出现,Ti阳离子的局部对称性系统地演化。样品中的阳离子,与样品被加热到的温度无关。

更新日期:2018-10-15
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