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DOE OSTI · 1189523

Materials Data on ZnSnO3 by Materials Project

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Abstract

ZnSnO3 is Ilmenite-like structured and crystallizes in the trigonal R3c space group. The structure is three-dimensional. Zn2+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. There are three shorter (2.03 Å) and three longer (2.36 Å) Zn–O bond lengths. Sn4+ is bonded to six equivalent O2- atoms to form corner-sharing SnO6 octahedra. The corner-sharing octahedral tilt angles are 45°. There are three shorter (2.07 Å) and three longer (2.13 Å) Sn–O bond lengths. O2- is bonded to two equivalent Zn2+ and two equivalent Sn4+ atoms to form a mixture of distorted edge and corner-sharing OZn2Sn2 trigonal pyramids.

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36 MATERIALS SCIENCEcrystal structureO-Sn-ZnZnSnO3

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2020-07-16. Materials Data on ZnSnO3 by Materials Project. https://doi.org/10.17188/1189523

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