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Title: Materials Data on UReB3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1202701· OSTI ID:1202701

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.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1202701
Report Number(s):
mp-28607
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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