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Materials Data on CeOF by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1759890· OSTI ID:1759890
CeOF is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is two-dimensional and consists of one CeOF sheet oriented in the (0, 0, 1) direction. Ce3+ is bonded in a 5-coordinate geometry to four equivalent O2- and one F1- atom. All Ce–O bond lengths are 2.33 Å. The Ce–F bond length is 2.38 Å. O2- is bonded to four equivalent Ce3+ atoms to form a mixture of corner and edge-sharing OCe4 tetrahedra. F1- is bonded in a single-bond geometry to one Ce3+ atom.
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:
1759890
Report Number(s):
mp-1178454
Country of Publication:
United States
Language:
English

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