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Title: Materials Data on K2Li4UO6 by Materials Project

Abstract

K2Li4UO6 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. K1+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All K–O bond lengths are 2.58 Å. There are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to six equivalent O2- atoms to form distorted LiO6 octahedra that share faces with two equivalent UO6 octahedra. All Li–O bond lengths are 2.41 Å. In the second Li1+ site, Li1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Li–O bond lengths are 2.13 Å. U6+ is bonded to six equivalent O2- atoms to form UO6 octahedra that share faces with two equivalent LiO6 octahedra. All U–O bond lengths are 2.09 Å. O2- is bonded to one K1+, three Li1+, and one U6+ atom to form a mixture of distorted edge and corner-sharing OKLi3U trigonal bipyramids.

Publication Date:
Other Number(s):
mp-559263
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; K2Li4UO6; K-Li-O-U
OSTI Identifier:
1270748
DOI:
10.17188/1270748

Citation Formats

The Materials Project. Materials Data on K2Li4UO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1270748.
The Materials Project. Materials Data on K2Li4UO6 by Materials Project. United States. doi:10.17188/1270748.
The Materials Project. 2020. "Materials Data on K2Li4UO6 by Materials Project". United States. doi:10.17188/1270748. https://www.osti.gov/servlets/purl/1270748. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1270748,
title = {Materials Data on K2Li4UO6 by Materials Project},
author = {The Materials Project},
abstractNote = {K2Li4UO6 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. K1+ is bonded in a 3-coordinate geometry to three equivalent O2- atoms. All K–O bond lengths are 2.58 Å. There are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded to six equivalent O2- atoms to form distorted LiO6 octahedra that share faces with two equivalent UO6 octahedra. All Li–O bond lengths are 2.41 Å. In the second Li1+ site, Li1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Li–O bond lengths are 2.13 Å. U6+ is bonded to six equivalent O2- atoms to form UO6 octahedra that share faces with two equivalent LiO6 octahedra. All U–O bond lengths are 2.09 Å. O2- is bonded to one K1+, three Li1+, and one U6+ atom to form a mixture of distorted edge and corner-sharing OKLi3U trigonal bipyramids.},
doi = {10.17188/1270748},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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