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Title: Materials Data on GdNi5 by Materials Project

Abstract

GdNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Gd is bonded in a 6-coordinate geometry to eighteen Ni atoms. There are six shorter (2.82 Å) and twelve longer (3.14 Å) Gd–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to four equivalent Gd and eight Ni atoms to form a mixture of corner, edge, and face-sharing NiGd4Ni8 cuboctahedra. There are four shorter (2.42 Å) and four longer (2.44 Å) Ni–Ni bond lengths. In the second Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Gd and six equivalent Ni atoms.

Publication Date:
Other Number(s):
mp-21305
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; GdNi5; Gd-Ni
OSTI Identifier:
1196615
DOI:
https://doi.org/10.17188/1196615

Citation Formats

The Materials Project. Materials Data on GdNi5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1196615.
The Materials Project. Materials Data on GdNi5 by Materials Project. United States. doi:https://doi.org/10.17188/1196615
The Materials Project. 2020. "Materials Data on GdNi5 by Materials Project". United States. doi:https://doi.org/10.17188/1196615. https://www.osti.gov/servlets/purl/1196615. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1196615,
title = {Materials Data on GdNi5 by Materials Project},
author = {The Materials Project},
abstractNote = {GdNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Gd is bonded in a 6-coordinate geometry to eighteen Ni atoms. There are six shorter (2.82 Å) and twelve longer (3.14 Å) Gd–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to four equivalent Gd and eight Ni atoms to form a mixture of corner, edge, and face-sharing NiGd4Ni8 cuboctahedra. There are four shorter (2.42 Å) and four longer (2.44 Å) Ni–Ni bond lengths. In the second Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Gd and six equivalent Ni atoms.},
doi = {10.17188/1196615},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}