Title: Materials Data on Cs2UBr6 by Materials Project

Abstract

Cs2UBr6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Br1- atoms to form CsBr12 cuboctahedra that share corners with twelve equivalent CsBr12 cuboctahedra, faces with six equivalent CsBr12 cuboctahedra, and faces with four equivalent UBr6 octahedra. All Cs–Br bond lengths are 4.05 Å. U4+ is bonded to six equivalent Br1- atoms to form UBr6 octahedra that share faces with eight equivalent CsBr12 cuboctahedra. All U–Br bond lengths are 2.79 Å. Br1- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one U4+ atom.

Publication Date:
Other Number(s):
mp-540735
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; Br-Cs-U; crystal structure; Cs2UBr6
OSTI Identifier:
1264750
DOI:
https://doi.org/10.17188/1264750

Citation Formats

Materials Data on Cs2UBr6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1264750.
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Materials Data on Cs2UBr6 by Materials Project. United States. doi:https://doi.org/10.17188/1264750
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2020. "Materials Data on Cs2UBr6 by Materials Project". United States. doi:https://doi.org/10.17188/1264750. https://www.osti.gov/servlets/purl/1264750. Pub date:Tue Jul 14 20:00:00 EDT 2020
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@article{osti_1264750,
title = {Materials Data on Cs2UBr6 by Materials Project},
abstractNote = {Cs2UBr6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Br1- atoms to form CsBr12 cuboctahedra that share corners with twelve equivalent CsBr12 cuboctahedra, faces with six equivalent CsBr12 cuboctahedra, and faces with four equivalent UBr6 octahedra. All Cs–Br bond lengths are 4.05 Å. U4+ is bonded to six equivalent Br1- atoms to form UBr6 octahedra that share faces with eight equivalent CsBr12 cuboctahedra. All U–Br bond lengths are 2.79 Å. Br1- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one U4+ atom.},
doi = {10.17188/1264750},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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DOI: https://doi.org/10.17188/1264750
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