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Materials Data on Th5Bi3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1688914· OSTI ID:1688914
Th5Bi3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Th sites. In the first Th site, Th is bonded in a 6-coordinate geometry to six equivalent Bi atoms. All Th–Bi bond lengths are 3.38 Å. In the second Th site, Th is bonded in a 5-coordinate geometry to five equivalent Bi atoms. There are a spread of Th–Bi bond distances ranging from 3.26–3.53 Å. Bi is bonded in a 9-coordinate geometry to nine Th 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:
1688914
Report Number(s):
mp-1106314
Country of Publication:
United States
Language:
English

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