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Materials Data on Ce(FeB)4 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1316723· OSTI ID:1316723
Ce(FeB)4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Ce3+ is bonded in a 12-coordinate geometry to eight equivalent B3- atoms. There are four shorter (2.78 Å) and four longer (2.82 Å) Ce–B bond lengths. Fe+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are a spread of Fe–B bond distances ranging from 2.02–2.37 Å. B3- is bonded in a 5-coordinate geometry to two equivalent Ce3+, five equivalent Fe+2.25+, and one B3- atom. The B–B bond length is 1.76 Å.
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:
1316723
Report Number(s):
mp-1006322
Country of Publication:
United States
Language:
English

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