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DOE OSTI · 1680979

Materials Data on CsSO4 by Materials Project

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Abstract

CsSO4 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Cs is bonded in a 12-coordinate geometry to twelve O atoms. There are a spread of Cs–O bond distances ranging from 3.26–3.68 Å. S is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.48 Å) and three longer (1.49 Å) S–O bond length. There are three inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the second O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the third O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom.

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36 MATERIALS SCIENCEcrystal structureCs-O-SCsSO4

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2020-05-02. Materials Data on CsSO4 by Materials Project. https://doi.org/10.17188/1680979

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