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Materials Data on LuAs by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1195309· OSTI ID:1195309
LuAs is Halite, Rock Salt structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Lu3+ is bonded to six equivalent As3- atoms to form a mixture of edge and corner-sharing LuAs6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Lu–As bond lengths are 2.85 Å. As3- is bonded to six equivalent Lu3+ atoms to form a mixture of edge and corner-sharing AsLu6 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:
1195309
Report Number(s):
mp-2017
Country of Publication:
United States
Language:
English

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