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Title: Materials Data on Nd3(SiNi3)2 by Materials Project

Abstract

Nd3(Ni3Si)2 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Ni and four equivalent Si atoms. There are four shorter (2.87 Å) and four longer (2.98 Å) Nd–Ni bond lengths. All Nd–Si bond lengths are 3.17 Å. Ni is bonded in a 12-coordinate geometry to four equivalent Nd, four equivalent Ni, and two equivalent Si atoms. All Ni–Ni bond lengths are 2.58 Å. Both Ni–Si bond lengths are 2.45 Å. Si is bonded to six equivalent Nd and six equivalent Ni atoms to form a mixture of face and corner-sharing SiNd6Ni6 cuboctahedra.

Publication Date:
Other Number(s):
mp-1190765
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; Nd3(SiNi3)2; Nd-Ni-Si
OSTI Identifier:
1664897
DOI:
https://doi.org/10.17188/1664897

Citation Formats

The Materials Project. Materials Data on Nd3(SiNi3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1664897.
The Materials Project. Materials Data on Nd3(SiNi3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1664897
The Materials Project. 2020. "Materials Data on Nd3(SiNi3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1664897. https://www.osti.gov/servlets/purl/1664897. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1664897,
title = {Materials Data on Nd3(SiNi3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Nd3(Ni3Si)2 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Ni and four equivalent Si atoms. There are four shorter (2.87 Å) and four longer (2.98 Å) Nd–Ni bond lengths. All Nd–Si bond lengths are 3.17 Å. Ni is bonded in a 12-coordinate geometry to four equivalent Nd, four equivalent Ni, and two equivalent Si atoms. All Ni–Ni bond lengths are 2.58 Å. Both Ni–Si bond lengths are 2.45 Å. Si is bonded to six equivalent Nd and six equivalent Ni atoms to form a mixture of face and corner-sharing SiNd6Ni6 cuboctahedra.},
doi = {10.17188/1664897},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}