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Title: Materials Data on CsNi2F6 by Materials Project

Abstract

CsNi2F6 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Cs1+ is bonded to six equivalent F1- atoms to form CsF6 octahedra that share corners with twelve equivalent NiF6 octahedra. The corner-sharing octahedral tilt angles are 69°. All Cs–F bond lengths are 3.15 Å. Ni+2.50+ is bonded to six equivalent F1- atoms to form NiF6 octahedra that share corners with six equivalent CsF6 octahedra and corners with six equivalent NiF6 octahedra. The corner-sharing octahedra tilt angles range from 43–69°. All Ni–F bond lengths are 1.95 Å. F1- is bonded in a 2-coordinate geometry to one Cs1+ and two equivalent Ni+2.50+ atoms.

Publication Date:
Other Number(s):
mp-647818
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; CsNi2F6; Cs-F-Ni
OSTI Identifier:
1280777
DOI:
https://doi.org/10.17188/1280777

Citation Formats

The Materials Project. Materials Data on CsNi2F6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280777.
The Materials Project. Materials Data on CsNi2F6 by Materials Project. United States. doi:https://doi.org/10.17188/1280777
The Materials Project. 2020. "Materials Data on CsNi2F6 by Materials Project". United States. doi:https://doi.org/10.17188/1280777. https://www.osti.gov/servlets/purl/1280777. Pub date:Mon Aug 03 00:00:00 EDT 2020
@article{osti_1280777,
title = {Materials Data on CsNi2F6 by Materials Project},
author = {The Materials Project},
abstractNote = {CsNi2F6 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Cs1+ is bonded to six equivalent F1- atoms to form CsF6 octahedra that share corners with twelve equivalent NiF6 octahedra. The corner-sharing octahedral tilt angles are 69°. All Cs–F bond lengths are 3.15 Å. Ni+2.50+ is bonded to six equivalent F1- atoms to form NiF6 octahedra that share corners with six equivalent CsF6 octahedra and corners with six equivalent NiF6 octahedra. The corner-sharing octahedra tilt angles range from 43–69°. All Ni–F bond lengths are 1.95 Å. F1- is bonded in a 2-coordinate geometry to one Cs1+ and two equivalent Ni+2.50+ atoms.},
doi = {10.17188/1280777},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {8}
}