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Title: Materials Data on CrNi3 by Materials Project

Abstract

Ni3Cr is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to fourteen Ni atoms. There are eight shorter (2.44 Å) and six longer (2.82 Å) Cr–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a distorted body-centered cubic geometry to four equivalent Cr and four equivalent Ni atoms. All Ni–Ni bond lengths are 2.44 Å. In the second Ni site, Ni is bonded in a 8-coordinate geometry to six equivalent Cr and eight equivalent Ni atoms.

Authors:
Publication Date:
Other Number(s):
mp-1007975
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; CrNi3; Cr-Ni
OSTI Identifier:
1324948
DOI:
https://doi.org/10.17188/1324948

Citation Formats

The Materials Project. Materials Data on CrNi3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1324948.
The Materials Project. Materials Data on CrNi3 by Materials Project. United States. doi:https://doi.org/10.17188/1324948
The Materials Project. 2020. "Materials Data on CrNi3 by Materials Project". United States. doi:https://doi.org/10.17188/1324948. https://www.osti.gov/servlets/purl/1324948. Pub date:Tue Jul 21 00:00:00 EDT 2020
@article{osti_1324948,
title = {Materials Data on CrNi3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ni3Cr is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to fourteen Ni atoms. There are eight shorter (2.44 Å) and six longer (2.82 Å) Cr–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a distorted body-centered cubic geometry to four equivalent Cr and four equivalent Ni atoms. All Ni–Ni bond lengths are 2.44 Å. In the second Ni site, Ni is bonded in a 8-coordinate geometry to six equivalent Cr and eight equivalent Ni atoms.},
doi = {10.17188/1324948},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}