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Title: Materials Data on CoF3 by Materials Project

Abstract

CoF3 is alpha Rhenium trioxide structured and crystallizes in the trigonal P321 space group. The structure is three-dimensional. there are two inequivalent Co3+ sites. In the first Co3+ site, Co3+ is bonded to six F1- atoms to form corner-sharing CoF6 octahedra. The corner-sharing octahedra tilt angles range from 0–1°. All Co–F bond lengths are 1.93 Å. In the second Co3+ site, Co3+ is bonded to six equivalent F1- atoms to form corner-sharing CoF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Co–F bond lengths are 1.93 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two Co3+ atoms. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Co3+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-559435
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; CoF3; Co-F
OSTI Identifier:
1270860
DOI:
https://doi.org/10.17188/1270860

Citation Formats

The Materials Project. Materials Data on CoF3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1270860.
The Materials Project. Materials Data on CoF3 by Materials Project. United States. doi:https://doi.org/10.17188/1270860
The Materials Project. 2020. "Materials Data on CoF3 by Materials Project". United States. doi:https://doi.org/10.17188/1270860. https://www.osti.gov/servlets/purl/1270860. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1270860,
title = {Materials Data on CoF3 by Materials Project},
author = {The Materials Project},
abstractNote = {CoF3 is alpha Rhenium trioxide structured and crystallizes in the trigonal P321 space group. The structure is three-dimensional. there are two inequivalent Co3+ sites. In the first Co3+ site, Co3+ is bonded to six F1- atoms to form corner-sharing CoF6 octahedra. The corner-sharing octahedra tilt angles range from 0–1°. All Co–F bond lengths are 1.93 Å. In the second Co3+ site, Co3+ is bonded to six equivalent F1- atoms to form corner-sharing CoF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Co–F bond lengths are 1.93 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two Co3+ atoms. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Co3+ atoms.},
doi = {10.17188/1270860},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}