U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on KLaS2O9 by Materials Project
Abstract
KLaS2O9 crystallizes in the trigonal P3_121 space group. The structure is three-dimensional. K is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of K–O bond distances ranging from 2.60–2.96 Å. La is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of La–O bond distances ranging from 2.52–2.66 Å. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.48–1.50 Å. There are five inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one K, one La, and one S atom. In the second O site, O is bonded in a 1-coordinate geometry to one K, one La, and one S atom. In the third O site, O is bonded in a 1-coordinate geometry to one K, one La, and one S atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one K, one La, and one S atom. In the fifth O site, O is bonded in a single-bond geometry to one La atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1211548
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- 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)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; KLaS2O9; K-La-O-S
- OSTI Identifier:
- 1738440
- DOI:
- https://doi.org/10.17188/1738440
Citation Formats
The Materials Project. Materials Data on KLaS2O9 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1738440.
The Materials Project. Materials Data on KLaS2O9 by Materials Project. United States. doi:https://doi.org/10.17188/1738440
The Materials Project. 2020.
"Materials Data on KLaS2O9 by Materials Project". United States. doi:https://doi.org/10.17188/1738440. https://www.osti.gov/servlets/purl/1738440. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1738440,
title = {Materials Data on KLaS2O9 by Materials Project},
author = {The Materials Project},
abstractNote = {KLaS2O9 crystallizes in the trigonal P3_121 space group. The structure is three-dimensional. K is bonded in a 8-coordinate geometry to eight O atoms. There are a spread of K–O bond distances ranging from 2.60–2.96 Å. La is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of La–O bond distances ranging from 2.52–2.66 Å. S is bonded in a tetrahedral geometry to four O atoms. There are a spread of S–O bond distances ranging from 1.48–1.50 Å. There are five inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to one K, one La, and one S atom. In the second O site, O is bonded in a 1-coordinate geometry to one K, one La, and one S atom. In the third O site, O is bonded in a 1-coordinate geometry to one K, one La, and one S atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one K, one La, and one S atom. In the fifth O site, O is bonded in a single-bond geometry to one La atom.},
doi = {10.17188/1738440},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}