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DOE OSTI · 1749122

Materials Data on CeZn3 by Materials Project

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Abstract

Zn3Ce crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to fourteen Zn atoms. There are a spread of Ce–Zn bond distances ranging from 3.04–3.50 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to five equivalent Ce and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.59–2.79 Å. In the second Zn site, Zn is bonded in a 10-coordinate geometry to five equivalent Ce and five Zn atoms. There are one shorter (2.65 Å) and two longer (2.88 Å) Zn–Zn bond lengths. In the third Zn site, Zn is bonded in a 10-coordinate geometry to four equivalent Ce and six Zn atoms.

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36 MATERIALS SCIENCECe-ZnCeZn3crystal structure

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2020-05-03. Materials Data on CeZn3 by Materials Project. https://doi.org/10.17188/1749122

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