正交RFeO3和RMnO3的结构畸变

R. Vilarinho, A. Almeida, J. Agostinho Moreira
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引用次数: 0

摘要

我们将详细讨论导致理想立方Pm-3m钙钛矿对称性降低到RFeO3和RMnO3 (R =三价稀土阳离子)的正交pma结构的结构畸变,这对这些材料中不同磁性和多铁性相的稳定很重要。我们还将展示毕尔巴鄂晶体服务器的Amplimodes工具如何用于量化这些畸变,并确定哪些声子可以用作八面体倾斜和变形的探针。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Structural distortions of orthorhombic RFeO3 and RMnO3
We will address in detail the structural distortions responsible for the symmetry lowering of the ideal cubic Pm-3m perovskite to the orthorhombic Pnma structure of RFeO3 and RMnO3 (R = trivalent rare-earth cation), important to the stabilization of the different magnetic and multiferroic phases in these materials. We will also show how the Amplimodes tool of Bilbao Crystallographic Server is useful in quantifying these distortions and establish which phonons can be used as probes of both the octahedra tilting and deformation.
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