U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cs4CO4 by Materials Project
Abstract
Cs4CO4 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.79–3.25 Å. In the second Cs1+ site, Cs1+ is bonded in a 1-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.66–3.60 Å. C4+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.43 Å) and two longer (1.45 Å) C–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four Cs1+ and one C4+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to four Cs1+ and one C4+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-645330
- 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; Cs4CO4; C-Cs-O
- OSTI Identifier:
- 1280534
- DOI:
- https://doi.org/10.17188/1280534
Citation Formats
The Materials Project. Materials Data on Cs4CO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1280534.
The Materials Project. Materials Data on Cs4CO4 by Materials Project. United States. doi:https://doi.org/10.17188/1280534
The Materials Project. 2020.
"Materials Data on Cs4CO4 by Materials Project". United States. doi:https://doi.org/10.17188/1280534. https://www.osti.gov/servlets/purl/1280534. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1280534,
title = {Materials Data on Cs4CO4 by Materials Project},
author = {The Materials Project},
abstractNote = {Cs4CO4 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.79–3.25 Å. In the second Cs1+ site, Cs1+ is bonded in a 1-coordinate geometry to four O2- atoms. There are a spread of Cs–O bond distances ranging from 2.66–3.60 Å. C4+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.43 Å) and two longer (1.45 Å) C–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to four Cs1+ and one C4+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to four Cs1+ and one C4+ atom.},
doi = {10.17188/1280534},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}