Materials Data on Ba2TaCrO6 by Materials Project

Kristin Persson
Ba2TaCrO6 is (Cubic) Perovskite-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are three inequivalent Ba2+ sites. In the first Ba2+ site, Ba2+ is bonded to twelve O2- atoms to form BaO12 cuboctahedra that share corners with twelve BaO12 cuboctahedra, faces with six equivalent BaO12 cuboctahedra, faces with two equivalent CrO6 octahedra, and faces with six equivalent TaO6 octahedra. There are six shorter (2.87 Å) and six longer (2.91...
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