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DOE OSTI · 1192596

Materials Data on CsReO4 by Materials Project

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Abstract

CsReO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Cs–O bond distances ranging from 3.17–3.39 Å. Re7+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.75 Å) and three longer (1.76 Å) Re–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Cs1+ and one Re7+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to three equivalent Cs1+ and one Re7+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to one Cs1+ and one Re7+ atom.

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36 MATERIALS SCIENCEcrystal structureCs-O-ReCsReO4

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2020-07-20. Materials Data on CsReO4 by Materials Project. https://doi.org/10.17188/1192596

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