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Materials Data on CuBr by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1275649· OSTI ID:1275649
CuBr is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cu1+ is bonded to six equivalent Br1- atoms to form a mixture of edge and corner-sharing CuBr6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Cu–Br bond lengths are 2.68 Å. Br1- is bonded to six equivalent Cu1+ atoms to form a mixture of edge and corner-sharing BrCu6 octahedra. The corner-sharing octahedral tilt angles are 0°.
Research Organization:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Contributing Organization:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231
OSTI ID:
1275649
Report Number(s):
mp-570354
Country of Publication:
United States
Language:
English

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