U.S. Department of EnergyOffice of Scientific and Technical Information
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.
- Publication Date:
- Other Number(s):
- mp-1182774
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Cs-O-S; CsSO4; crystal structure
- OSTI Identifier:
- 1681244
- DOI:
- https://doi.org/10.17188/1681244
Citation Formats
Materials Data on CsSO4 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1681244.
Materials Data on CsSO4 by Materials Project. United States. doi:https://doi.org/10.17188/1681244
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 04:00:00 UTC 2019
@article{osti_1681244,
title = {Materials Data on CsSO4 by 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}
}