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DOE OSTI · 1196407

Materials Data on Pr3InO by Materials Project

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Abstract

Pr3InO is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Pr is bonded in a linear geometry to four equivalent In and two equivalent O atoms. All Pr–In bond lengths are 3.56 Å. Both Pr–O bond lengths are 2.52 Å. In is bonded to twelve equivalent Pr atoms to form InPr12 cuboctahedra that share corners with twelve equivalent InPr12 cuboctahedra, faces with six equivalent InPr12 cuboctahedra, and faces with eight equivalent OPr6 octahedra. O is bonded to six equivalent Pr atoms to form OPr6 octahedra that share corners with six equivalent OPr6 octahedra and faces with eight equivalent InPr12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

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36 MATERIALS SCIENCEcrystal structureIn-O-PrPr3InO

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2020-07-16. Materials Data on Pr3InO by Materials Project. https://doi.org/10.17188/1196407

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