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DOE OSTI · 1698544

Materials Data on LiAlO3 by Materials Project

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Abstract

LiAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Li is bonded to twelve equivalent O atoms to form LiO12 cuboctahedra that share corners with twelve equivalent LiO12 cuboctahedra, faces with six equivalent LiO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All Li–O bond lengths are 2.62 Å. Al is bonded to six equivalent O atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent LiO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.85 Å. O is bonded in a linear geometry to four equivalent Li and two equivalent Al atoms.

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36 MATERIALS SCIENCEAl-Li-Ocrystal structureLiAlO3

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2020-05-04. Materials Data on LiAlO3 by Materials Project. https://doi.org/10.17188/1698544

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