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DOE OSTI · 1314286

Materials Data on KErO3 by Materials Project

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Abstract

KErO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. K is bonded to twelve equivalent O atoms to form KO12 cuboctahedra that share corners with twelve equivalent KO12 cuboctahedra, faces with six equivalent KO12 cuboctahedra, and faces with eight equivalent ErO6 octahedra. All K–O bond lengths are 3.13 Å. Er is bonded to six equivalent O atoms to form ErO6 octahedra that share corners with six equivalent ErO6 octahedra and faces with eight equivalent KO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Er–O bond lengths are 2.21 Å. O is bonded in a distorted linear geometry to four equivalent K and two equivalent Er atoms.

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36 MATERIALS SCIENCEcrystal structureEr-K-OKErO3

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2020-07-23. Materials Data on KErO3 by Materials Project. https://doi.org/10.17188/1314286

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