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Materials Data on Sr3Th by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1720651· OSTI ID:1720651
Sr3Th is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Sr sites. In the first Sr site, Sr is bonded in a distorted body-centered cubic geometry to four equivalent Sr and four equivalent Th atoms. All Sr–Sr bond lengths are 3.88 Å. All Sr–Th bond lengths are 3.88 Å. In the second Sr site, Sr is bonded in a 8-coordinate geometry to eight equivalent Sr and six equivalent Th atoms. All Sr–Th bond lengths are 4.48 Å. Th is bonded in a distorted body-centered cubic geometry to fourteen Sr 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:
1720651
Report Number(s):
mp-1187140
Country of Publication:
United States
Language:
English

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