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DOE OSTI · 1655082

Materials Data on Li2CuSbCl6 by Materials Project

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Abstract

(Li)2CuSbCl6 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 CuSbCl6 framework. In the CuSbCl6 framework, Cu1+ is bonded to six equivalent Cl1- atoms to form CuCl6 octahedra that share corners with six equivalent SbCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–Cl bond lengths are 2.46 Å. Sb3+ is bonded to six equivalent Cl1- atoms to form SbCl6 octahedra that share corners with six equivalent CuCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Sb–Cl bond lengths are 2.65 Å. Cl1- is bonded in a linear geometry to one Cu1+ and one Sb3+ atom.

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36 MATERIALS SCIENCECl-Cu-Li-Sbcrystal structureLi2CuSbCl6

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2020-05-02. Materials Data on Li2CuSbCl6 by Materials Project. https://doi.org/10.17188/1655082

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DOE OSTI2026

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