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Title: Materials Data on Na3Ni by Materials Project

Abstract

Na3Ni is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded in a distorted body-centered cubic geometry to eight equivalent Na and six equivalent Ni atoms. All Na–Na bond lengths are 3.15 Å. All Na–Ni bond lengths are 3.64 Å. In the second Na site, Na is bonded to four equivalent Na and four equivalent Ni atoms to form a mixture of distorted edge, face, and corner-sharing NaNa4Ni4 tetrahedra. All Na–Ni bond lengths are 3.15 Å. Ni is bonded in a body-centered cubic geometry to fourteen Na atoms.

Publication Date:
Other Number(s):
mp-1186073
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; Na3Ni; Na-Ni
OSTI Identifier:
1651515
DOI:
https://doi.org/10.17188/1651515

Citation Formats

The Materials Project. Materials Data on Na3Ni by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1651515.
The Materials Project. Materials Data on Na3Ni by Materials Project. United States. doi:https://doi.org/10.17188/1651515
The Materials Project. 2020. "Materials Data on Na3Ni by Materials Project". United States. doi:https://doi.org/10.17188/1651515. https://www.osti.gov/servlets/purl/1651515. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1651515,
title = {Materials Data on Na3Ni by Materials Project},
author = {The Materials Project},
abstractNote = {Na3Ni is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded in a distorted body-centered cubic geometry to eight equivalent Na and six equivalent Ni atoms. All Na–Na bond lengths are 3.15 Å. All Na–Ni bond lengths are 3.64 Å. In the second Na site, Na is bonded to four equivalent Na and four equivalent Ni atoms to form a mixture of distorted edge, face, and corner-sharing NaNa4Ni4 tetrahedra. All Na–Ni bond lengths are 3.15 Å. Ni is bonded in a body-centered cubic geometry to fourteen Na atoms.},
doi = {10.17188/1651515},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}