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DOE OSTI · 1697576

Materials Data on NdCO4 by Materials Project

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Abstract

NdCO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Nd is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of Nd–O bond distances ranging from 2.45–2.64 Å. C is bonded in a trigonal planar geometry to three O atoms. All C–O bond lengths are 1.30 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to two equivalent Nd atoms. In the second O site, O is bonded in a 1-coordinate geometry to two equivalent Nd and one C atom. In the third O site, O is bonded in a distorted single-bond geometry to two equivalent Nd and one C atom.

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36 MATERIALS SCIENCEC-Nd-Ocrystal structureNdCO4

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2020-05-02. Materials Data on NdCO4 by Materials Project. https://doi.org/10.17188/1697576

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36 MATERIALS SCIENCE↗