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Materials Data on GdClO2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1752585· OSTI ID:1752585
GdO2Cl crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Gd is bonded in a 9-coordinate geometry to six O and three equivalent Cl atoms. There are a spread of Gd–O bond distances ranging from 2.30–2.46 Å. There are two shorter (2.84 Å) and one longer (2.94 Å) Gd–Cl bond lengths. There are two inequivalent O sites. In the first O site, O is bonded in a distorted trigonal planar geometry to three equivalent Gd atoms. In the second O site, O is bonded in a trigonal non-coplanar geometry to three equivalent Gd atoms. Cl is bonded in a distorted trigonal non-coplanar geometry to three equivalent Gd 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:
1752585
Report Number(s):
mp-1079326
Country of Publication:
United States
Language:
English

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