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Title: Materials Data on UOF4 by Materials Project

Abstract

UOF4 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. U6+ is bonded to one O2- and six F1- atoms to form distorted corner-sharing UOF6 pentagonal bipyramids. The U–O bond length is 1.82 Å. There are a spread of U–F bond distances ranging from 2.03–2.51 Å. O2- is bonded in a single-bond geometry to one U6+ atom. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 1-coordinate geometry to two equivalent U6+ atoms. In the second F1- site, F1- is bonded in a single-bond geometry to one U6+ atom.

Authors:
Publication Date:
Other Number(s):
mp-17004
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; UOF4; F-O-U
OSTI Identifier:
1192283
DOI:
https://doi.org/10.17188/1192283

Citation Formats

The Materials Project. Materials Data on UOF4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192283.
The Materials Project. Materials Data on UOF4 by Materials Project. United States. doi:https://doi.org/10.17188/1192283
The Materials Project. 2020. "Materials Data on UOF4 by Materials Project". United States. doi:https://doi.org/10.17188/1192283. https://www.osti.gov/servlets/purl/1192283. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1192283,
title = {Materials Data on UOF4 by Materials Project},
author = {The Materials Project},
abstractNote = {UOF4 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. U6+ is bonded to one O2- and six F1- atoms to form distorted corner-sharing UOF6 pentagonal bipyramids. The U–O bond length is 1.82 Å. There are a spread of U–F bond distances ranging from 2.03–2.51 Å. O2- is bonded in a single-bond geometry to one U6+ atom. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a 1-coordinate geometry to two equivalent U6+ atoms. In the second F1- site, F1- is bonded in a single-bond geometry to one U6+ atom.},
doi = {10.17188/1192283},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}