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Materials Data on Li2InCuF6 by Materials Project

(Li)2CuInF6 is High-temperature superconductor-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight lithium molecules and one CuInF6 framework. In the CuInF6 framework, Cu1+ is bonded to six equivalent F1- atoms to form CuF6 octahedra that share corners with six equivalent InF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–F bond lengths are 2.11 Å. In3+ is bonded to six equivalent F1- atoms to form InF6 octahedra that share corners with six equivalent CuF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All In–F bond lengths are 2.11 Å. F1- is bonded in a linear geometry to one Cu1+ and one In3+ atom.

36 MATERIALS SCIENCE↗