U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cs2ReO4 by Materials Project
Abstract
Cs2ReO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Cs–O bond distances ranging from 3.09–3.64 Å. In the second Cs1+ site, Cs1+ is bonded in a 1-coordinate geometry to ten O2- atoms. There are a spread of Cs–O bond distances ranging from 2.99–3.72 Å. Re6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Re–O bond distances ranging from 1.80–1.82 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to five Cs1+ and one Re6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Cs1+ and one Re6+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to five Cs1+ and one Re6+ atom.
- Publication Date:
- Other Number(s):
- mp-1096938
- 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-Re; Cs2ReO4; crystal structure
- OSTI Identifier:
- 1698751
- DOI:
- https://doi.org/10.17188/1698751
Citation Formats
Materials Data on Cs2ReO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1698751.
Materials Data on Cs2ReO4 by Materials Project. United States. doi:https://doi.org/10.17188/1698751
2020.
"Materials Data on Cs2ReO4 by Materials Project". United States. doi:https://doi.org/10.17188/1698751. https://www.osti.gov/servlets/purl/1698751. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1698751,
title = {Materials Data on Cs2ReO4 by Materials Project},
abstractNote = {Cs2ReO4 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Cs1+ sites. In the first Cs1+ site, Cs1+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Cs–O bond distances ranging from 3.09–3.64 Å. In the second Cs1+ site, Cs1+ is bonded in a 1-coordinate geometry to ten O2- atoms. There are a spread of Cs–O bond distances ranging from 2.99–3.72 Å. Re6+ is bonded in a tetrahedral geometry to four O2- atoms. There are a spread of Re–O bond distances ranging from 1.80–1.82 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to five Cs1+ and one Re6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Cs1+ and one Re6+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to five Cs1+ and one Re6+ atom.},
doi = {10.17188/1698751},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}