U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsCoH24(SO10)2 by Materials Project
Abstract
CsCoH24(SO10)2 crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Cs1+ is bonded in a 12-coordinate geometry to six equivalent O2- atoms. All Cs–O bond lengths are 3.18 Å. Co3+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Co–O bond lengths are 1.92 Å. There are four inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the second H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.59 Å) H–O bond length. In the third H1+ site, H1+ is bonded in a distorted single-bond geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.67 Å) H–O bond length. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is three shorter (1.49 Å) and one longer (1.51 Å) S–O bond length. There are four inequivalent O2- sites. In the first O2- site,more »
- Publication Date:
- Other Number(s):
- mp-850504
- 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; Co-Cs-H-O-S; CsCoH24(SO10)2; crystal structure
- OSTI Identifier:
- 1308741
- DOI:
- https://doi.org/10.17188/1308741
Citation Formats
Materials Data on CsCoH24(SO10)2 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1308741.
Materials Data on CsCoH24(SO10)2 by Materials Project. United States. doi:https://doi.org/10.17188/1308741
2017.
"Materials Data on CsCoH24(SO10)2 by Materials Project". United States. doi:https://doi.org/10.17188/1308741. https://www.osti.gov/servlets/purl/1308741. Pub date:Wed May 10 00:00:00 EDT 2017
@article{osti_1308741,
title = {Materials Data on CsCoH24(SO10)2 by Materials Project},
abstractNote = {CsCoH24(SO10)2 crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Cs1+ is bonded in a 12-coordinate geometry to six equivalent O2- atoms. All Cs–O bond lengths are 3.18 Å. Co3+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Co–O bond lengths are 1.92 Å. There are four inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. In the second H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.59 Å) H–O bond length. In the third H1+ site, H1+ is bonded in a distorted single-bond geometry to two O2- atoms. There is one shorter (1.01 Å) and one longer (1.67 Å) H–O bond length. In the fourth H1+ site, H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is three shorter (1.49 Å) and one longer (1.51 Å) S–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a single-bond geometry to one S6+ atom. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Co3+ and two H1+ atoms. In the third O2- site, O2- is bonded in a 2-coordinate geometry to one Cs1+ and three H1+ atoms. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to one H1+ and one S6+ atom.},
doi = {10.17188/1308741},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}