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Materials Data on Sc5Ga3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1192453· OSTI ID:1192453
Sc5Ga3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Sc sites. In the first Sc site, Sc is bonded in a 6-coordinate geometry to six equivalent Ga atoms. All Sc–Ga bond lengths are 2.89 Å. In the second Sc site, Sc is bonded in a 5-coordinate geometry to five equivalent Ga atoms. There are a spread of Sc–Ga bond distances ranging from 2.83–3.24 Å. Ga is bonded in a 9-coordinate geometry to nine Sc atoms.
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:
1192453
Report Number(s):
mp-17332
Country of Publication:
United States
Language:
English

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