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DOE OSTI · 1731839

Materials Data on Cs3LaCl6 by Materials Project

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Abstract

Cs3LaCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight cesium molecules and one CsLaCl6 framework. In the CsLaCl6 framework, Cs1+ is bonded to six equivalent Cl1- atoms to form CsCl6 octahedra that share corners with six equivalent LaCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cs–Cl bond lengths are 3.29 Å. La3+ is bonded to six equivalent Cl1- atoms to form LaCl6 octahedra that share corners with six equivalent CsCl6 octahedra. The corner-sharing octahedral tilt angles are 0°. All La–Cl bond lengths are 2.78 Å. Cl1- is bonded in a linear geometry to one Cs1+ and one La3+ atom.

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36 MATERIALS SCIENCECl-Cs-Lacrystal structureCs3LaCl6

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2020-05-02. Materials Data on Cs3LaCl6 by Materials Project. https://doi.org/10.17188/1731839

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