U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsH3O2 by Materials Project
Abstract
CsH3O2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Cs1+ is bonded to twelve H1+ atoms to form a mixture of distorted edge, face, and corner-sharing CsH12 cuboctahedra. There are eight shorter (3.04 Å) and four longer (3.10 Å) Cs–H bond lengths. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a linear geometry to four equivalent Cs1+ and two equivalent O2- atoms. Both H–O bond lengths are 1.23 Å. In the second H1+ site, H1+ is bonded in a linear geometry to four equivalent Cs1+ and two equivalent O2- atoms. Both H–O bond lengths are 1.23 Å. O2- is bonded in a trigonal planar geometry to three H1+ atoms.
- Publication Date:
- Other Number(s):
- mp-30089
- 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-H-O; CsH3O2; crystal structure
- OSTI Identifier:
- 1204517
- DOI:
- https://doi.org/10.17188/1204517
Citation Formats
Materials Data on CsH3O2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1204517.
Materials Data on CsH3O2 by Materials Project. United States. doi:https://doi.org/10.17188/1204517
2020.
"Materials Data on CsH3O2 by Materials Project". United States. doi:https://doi.org/10.17188/1204517. https://www.osti.gov/servlets/purl/1204517. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1204517,
title = {Materials Data on CsH3O2 by Materials Project},
abstractNote = {CsH3O2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Cs1+ is bonded to twelve H1+ atoms to form a mixture of distorted edge, face, and corner-sharing CsH12 cuboctahedra. There are eight shorter (3.04 Å) and four longer (3.10 Å) Cs–H bond lengths. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a linear geometry to four equivalent Cs1+ and two equivalent O2- atoms. Both H–O bond lengths are 1.23 Å. In the second H1+ site, H1+ is bonded in a linear geometry to four equivalent Cs1+ and two equivalent O2- atoms. Both H–O bond lengths are 1.23 Å. O2- is bonded in a trigonal planar geometry to three H1+ atoms.},
doi = {10.17188/1204517},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.