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Title: Materials Data on NdInCo2 by Materials Project

Abstract

NdCo2In crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. Nd is bonded in a 1-coordinate geometry to seven Co and six equivalent In atoms. There are a spread of Nd–Co bond distances ranging from 2.71–3.16 Å. There are four shorter (3.29 Å) and two longer (3.40 Å) Nd–In bond lengths. There are two inequivalent Co sites. In the first Co site, Co is bonded to four equivalent Nd, six Co, and two equivalent In atoms to form a mixture of face, edge, and corner-sharing CoNd4In2Co6 cuboctahedra. There are four shorter (2.49 Å) and two longer (2.55 Å) Co–Co bond lengths. Both Co–In bond lengths are 2.78 Å. In the second Co site, Co is bonded in a 9-coordinate geometry to three equivalent Nd, four equivalent Co, and two equivalent In atoms. Both Co–In bond lengths are 2.72 Å. In is bonded in a 12-coordinate geometry to six equivalent Nd and four Co atoms.

Publication Date:
Other Number(s):
mp-1078606
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; NdInCo2; Co-In-Nd
OSTI Identifier:
1742161
DOI:
https://doi.org/10.17188/1742161

Citation Formats

The Materials Project. Materials Data on NdInCo2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1742161.
The Materials Project. Materials Data on NdInCo2 by Materials Project. United States. doi:https://doi.org/10.17188/1742161
The Materials Project. 2020. "Materials Data on NdInCo2 by Materials Project". United States. doi:https://doi.org/10.17188/1742161. https://www.osti.gov/servlets/purl/1742161. Pub date:Sun Apr 26 00:00:00 EDT 2020
@article{osti_1742161,
title = {Materials Data on NdInCo2 by Materials Project},
author = {The Materials Project},
abstractNote = {NdCo2In crystallizes in the orthorhombic Pmma space group. The structure is three-dimensional. Nd is bonded in a 1-coordinate geometry to seven Co and six equivalent In atoms. There are a spread of Nd–Co bond distances ranging from 2.71–3.16 Å. There are four shorter (3.29 Å) and two longer (3.40 Å) Nd–In bond lengths. There are two inequivalent Co sites. In the first Co site, Co is bonded to four equivalent Nd, six Co, and two equivalent In atoms to form a mixture of face, edge, and corner-sharing CoNd4In2Co6 cuboctahedra. There are four shorter (2.49 Å) and two longer (2.55 Å) Co–Co bond lengths. Both Co–In bond lengths are 2.78 Å. In the second Co site, Co is bonded in a 9-coordinate geometry to three equivalent Nd, four equivalent Co, and two equivalent In atoms. Both Co–In bond lengths are 2.72 Å. In is bonded in a 12-coordinate geometry to six equivalent Nd and four Co atoms.},
doi = {10.17188/1742161},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}