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Title: Materials Data on U4BiO10 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1289164· OSTI ID:1289164

U4BiO10 is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. U+4.25+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are a spread of U–O bond distances ranging from 2.32–2.35 Å. Bi3+ is bonded in a body-centered cubic geometry to eight equivalent O2- atoms. All Bi–O bond lengths are 2.43 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to three equivalent U+4.25+ and one Bi3+ atom to form a mixture of edge and corner-sharing OU3Bi tetrahedra. In the second O2- site, O2- is bonded to four equivalent U+4.25+ atoms to form a mixture of edge and corner-sharing OU4 tetrahedra.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1289164
Report Number(s):
mp-753853
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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