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Title: Materials Data on K2Yb2O3 by Materials Project

Abstract

K2Yb2O3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. K1+ is bonded in a 3-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.76–3.10 Å. Yb2+ is bonded to four O2- atoms to form a mixture of edge and corner-sharing YbO4 tetrahedra. There are a spread of Yb–O bond distances ranging from 2.20–2.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent K1+ and two equivalent Yb2+ atoms to form corner-sharing OK4Yb2 octahedra. The corner-sharing octahedral tilt angles are 61°. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent K1+ and three equivalent Yb2+ atoms.

Publication Date:
Other Number(s):
mp-758068
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; K2Yb2O3; K-O-Yb
OSTI Identifier:
1290975
DOI:
10.17188/1290975

Citation Formats

The Materials Project. Materials Data on K2Yb2O3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1290975.
The Materials Project. Materials Data on K2Yb2O3 by Materials Project. United States. doi:10.17188/1290975.
The Materials Project. 2020. "Materials Data on K2Yb2O3 by Materials Project". United States. doi:10.17188/1290975. https://www.osti.gov/servlets/purl/1290975. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1290975,
title = {Materials Data on K2Yb2O3 by Materials Project},
author = {The Materials Project},
abstractNote = {K2Yb2O3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. K1+ is bonded in a 3-coordinate geometry to four O2- atoms. There are a spread of K–O bond distances ranging from 2.76–3.10 Å. Yb2+ is bonded to four O2- atoms to form a mixture of edge and corner-sharing YbO4 tetrahedra. There are a spread of Yb–O bond distances ranging from 2.20–2.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to four equivalent K1+ and two equivalent Yb2+ atoms to form corner-sharing OK4Yb2 octahedra. The corner-sharing octahedral tilt angles are 61°. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent K1+ and three equivalent Yb2+ atoms.},
doi = {10.17188/1290975},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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