Materials Data on FeF3 by Materials Project
Abstract
FeF3 is alpha Rhenium trioxide structured and crystallizes in the trigonal P321 space group. The structure is three-dimensional. there are two inequivalent Fe3+ sites. In the first Fe3+ site, Fe3+ is bonded to six F1- atoms to form corner-sharing FeF6 octahedra. The corner-sharing octahedra tilt angles range from 1–2°. All Fe–F bond lengths are 1.95 Å. In the second Fe3+ site, Fe3+ is bonded to six equivalent F1- atoms to form corner-sharing FeF6 octahedra. The corner-sharing octahedral tilt angles are 1°. All Fe–F bond lengths are 1.95 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two Fe3+ atoms. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Fe3+ atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-558852
- 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; FeF3; F-Fe
- OSTI Identifier:
- 1270528
- DOI:
- https://doi.org/10.17188/1270528
Citation Formats
The Materials Project. Materials Data on FeF3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1270528.
The Materials Project. Materials Data on FeF3 by Materials Project. United States. doi:https://doi.org/10.17188/1270528
The Materials Project. 2020.
"Materials Data on FeF3 by Materials Project". United States. doi:https://doi.org/10.17188/1270528. https://www.osti.gov/servlets/purl/1270528. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1270528,
title = {Materials Data on FeF3 by Materials Project},
author = {The Materials Project},
abstractNote = {FeF3 is alpha Rhenium trioxide structured and crystallizes in the trigonal P321 space group. The structure is three-dimensional. there are two inequivalent Fe3+ sites. In the first Fe3+ site, Fe3+ is bonded to six F1- atoms to form corner-sharing FeF6 octahedra. The corner-sharing octahedra tilt angles range from 1–2°. All Fe–F bond lengths are 1.95 Å. In the second Fe3+ site, Fe3+ is bonded to six equivalent F1- atoms to form corner-sharing FeF6 octahedra. The corner-sharing octahedral tilt angles are 1°. All Fe–F bond lengths are 1.95 Å. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a linear geometry to two Fe3+ atoms. In the second F1- site, F1- is bonded in a linear geometry to two equivalent Fe3+ atoms.},
doi = {10.17188/1270528},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 23 00:00:00 EDT 2020},
month = {Thu Jul 23 00:00:00 EDT 2020}
}