U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Rb2CO3 by Materials Project
Abstract
Rb2CO3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded to six O2- atoms to form face-sharing RbO6 octahedra. There are a spread of Rb–O bond distances ranging from 2.82–3.02 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.01–3.27 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There is one shorter (1.30 Å) and two longer (1.31 Å) C–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to five Rb1+ and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Rb1+ and one C4+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to five Rb1+ and one C4+ atom.
- Publication Date:
- Other Number(s):
- mp-4138
- 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; C-O-Rb; Rb2CO3; crystal structure
- OSTI Identifier:
- 1207884
- DOI:
- https://doi.org/10.17188/1207884
Citation Formats
Materials Data on Rb2CO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1207884.
Materials Data on Rb2CO3 by Materials Project. United States. doi:https://doi.org/10.17188/1207884
2020.
"Materials Data on Rb2CO3 by Materials Project". United States. doi:https://doi.org/10.17188/1207884. https://www.osti.gov/servlets/purl/1207884. Pub date:Fri Jul 24 04:00:00 UTC 2020
@article{osti_1207884,
title = {Materials Data on Rb2CO3 by Materials Project},
abstractNote = {Rb2CO3 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Rb1+ sites. In the first Rb1+ site, Rb1+ is bonded to six O2- atoms to form face-sharing RbO6 octahedra. There are a spread of Rb–O bond distances ranging from 2.82–3.02 Å. In the second Rb1+ site, Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.01–3.27 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There is one shorter (1.30 Å) and two longer (1.31 Å) C–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to five Rb1+ and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to four Rb1+ and one C4+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to five Rb1+ and one C4+ atom.},
doi = {10.17188/1207884},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}