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Title: Materials Data on U(ClO)2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1199165· OSTI ID:1199165

UO2Cl2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. U6+ is bonded in a distorted linear geometry to three O2- and four equivalent Cl1- atoms. There are a spread of U–O bond distances ranging from 1.78–2.52 Å. There are two shorter (2.73 Å) and two longer (2.78 Å) U–Cl bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted linear geometry to two equivalent U6+ atoms. In the second O2- site, O2- is bonded in a single-bond geometry to one U6+ atom. Cl1- is bonded in a 2-coordinate geometry to two equivalent U6+ atoms.

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:
1199165
Report Number(s):
mp-23013
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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