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DOE OSTI · 1711714

Materials Data on YbPdO3 by Materials Project

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Abstract

YbPdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Yb2+ is bonded to twelve equivalent O2- atoms to form YbO12 cuboctahedra that share corners with twelve equivalent YbO12 cuboctahedra, faces with six equivalent YbO12 cuboctahedra, and faces with eight equivalent PdO6 octahedra. All Yb–O bond lengths are 2.78 Å. Pd4+ is bonded to six equivalent O2- atoms to form PdO6 octahedra that share corners with six equivalent PdO6 octahedra and faces with eight equivalent YbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Pd–O bond lengths are 1.97 Å. O2- is bonded to four equivalent Yb2+ and two equivalent Pd4+ atoms to form a mixture of distorted edge, face, and corner-sharing OYb4Pd2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.

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36 MATERIALS SCIENCEcrystal structureO-Pd-YbYbPdO3

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2020-05-04. Materials Data on YbPdO3 by Materials Project. https://doi.org/10.17188/1711714

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