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DOE OSTI · 1272562

Materials Data on CsGdO3 by Materials Project

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Abstract

CsGdO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cs is bonded to twelve equivalent O atoms to form CsO12 cuboctahedra that share corners with twelve equivalent CsO12 cuboctahedra, faces with six equivalent CsO12 cuboctahedra, and faces with eight equivalent GdO6 octahedra. All Cs–O bond lengths are 3.21 Å. Gd is bonded to six equivalent O atoms to form GdO6 octahedra that share corners with six equivalent GdO6 octahedra and faces with eight equivalent CsO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Gd–O bond lengths are 2.27 Å. O is bonded in a distorted linear geometry to four equivalent Cs and two equivalent Gd atoms.

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36 MATERIALS SCIENCEcrystal structureCs-Gd-OCsGdO3

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2020-07-20. Materials Data on CsGdO3 by Materials Project. https://doi.org/10.17188/1272562

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DOE OSTI2026

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