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DOE OSTI · 1298357

Materials Data on LaBiO3 by Materials Project

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Abstract

LaBiO3 is Ilmenite-like structured and crystallizes in the trigonal R3c space group. The structure is three-dimensional. La3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. There are three shorter (2.39 Å) and three longer (2.52 Å) La–O bond lengths. Bi3+ is bonded to six equivalent O2- atoms to form distorted corner-sharing BiO6 octahedra. The corner-sharing octahedral tilt angles are 47°. There are three shorter (2.31 Å) and three longer (2.53 Å) Bi–O bond lengths. O2- is bonded to two equivalent La3+ and two equivalent Bi3+ atoms to form a mixture of distorted edge and corner-sharing OLa2Bi2 trigonal pyramids.

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36 MATERIALS SCIENCEBi-La-Ocrystal structureLaBiO3

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2020-07-20. Materials Data on LaBiO3 by Materials Project. https://doi.org/10.17188/1298357

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