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Title: Materials Data on UReB3 by Materials Project

Abstract

UReB3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. U6+ is bonded in a 12-coordinate geometry to twelve equivalent B3- atoms. There are six shorter (2.58 Å) and six longer (2.75 Å) U–B bond lengths. Re3+ is bonded to six equivalent B3- atoms to form face-sharing ReB6 octahedra. All Re–B bond lengths are 2.32 Å. B3- is bonded in a 8-coordinate geometry to four equivalent U6+, two equivalent Re3+, and two equivalent B3- atoms. Both B–B bond lengths are 1.73 Å.

Publication Date:
Other Number(s):
mp-28607
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; B-Re-U; UReB3; crystal structure
OSTI Identifier:
1202701
DOI:
https://doi.org/10.17188/1202701

Citation Formats

Materials Data on UReB3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1202701.
Materials Data on UReB3 by Materials Project. United States. doi:https://doi.org/10.17188/1202701
2020. "Materials Data on UReB3 by Materials Project". United States. doi:https://doi.org/10.17188/1202701. https://www.osti.gov/servlets/purl/1202701. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1202701,
title = {Materials Data on UReB3 by Materials Project},
abstractNote = {UReB3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. U6+ is bonded in a 12-coordinate geometry to twelve equivalent B3- atoms. There are six shorter (2.58 Å) and six longer (2.75 Å) U–B bond lengths. Re3+ is bonded to six equivalent B3- atoms to form face-sharing ReB6 octahedra. All Re–B bond lengths are 2.32 Å. B3- is bonded in a 8-coordinate geometry to four equivalent U6+, two equivalent Re3+, and two equivalent B3- atoms. Both B–B bond lengths are 1.73 Å.},
doi = {10.17188/1202701},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}