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Title: Materials Data on CsSO4 by Materials Project

Abstract

CsSO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cs is bonded in a 12-coordinate geometry to twelve O atoms. There are a spread of Cs–O bond distances ranging from 3.15–3.66 Å. S is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.47 Å) and three longer (1.50 Å) S–O bond length. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the second O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the third O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the fourth O site, O is bonded in a distorted single-bond geometry to three equivalent Cs and one S atom.

Authors:
Publication Date:
Other Number(s):
mp-1182774
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; CsSO4; Cs-O-S
OSTI Identifier:
1681244
DOI:
https://doi.org/10.17188/1681244

Citation Formats

The Materials Project. Materials Data on CsSO4 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1681244.
The Materials Project. Materials Data on CsSO4 by Materials Project. United States. doi:https://doi.org/10.17188/1681244
The Materials Project. 2019. "Materials Data on CsSO4 by Materials Project". United States. doi:https://doi.org/10.17188/1681244. https://www.osti.gov/servlets/purl/1681244. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1681244,
title = {Materials Data on CsSO4 by Materials Project},
author = {The Materials Project},
abstractNote = {CsSO4 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Cs is bonded in a 12-coordinate geometry to twelve O atoms. There are a spread of Cs–O bond distances ranging from 3.15–3.66 Å. S is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.47 Å) and three longer (1.50 Å) S–O bond length. There are four inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the second O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the third O site, O is bonded in a single-bond geometry to three equivalent Cs and one S atom. In the fourth O site, O is bonded in a distorted single-bond geometry to three equivalent Cs and one S atom.},
doi = {10.17188/1681244},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}