U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cs2Sr2(CO3)3 by Materials Project
Abstract
Cs2Sr2(CO3)3 crystallizes in the cubic I2_13 space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are three shorter (3.06 Å) and three longer (3.14 Å) Cs–O bond lengths. Sr2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Sr–O bond distances ranging from 2.58–3.06 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.30 Å) and one longer (1.31 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 two equivalent Cs1+, two equivalent Sr2+, and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one Cs1+, two equivalent Sr2+, and one C4+ atom.
- Publication Date:
- Other Number(s):
- mp-866617
- 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-Cs-O-Sr; Cs2Sr2(CO3)3; crystal structure
- OSTI Identifier:
- 1311607
- DOI:
- https://doi.org/10.17188/1311607
Citation Formats
Materials Data on Cs2Sr2(CO3)3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1311607.
Materials Data on Cs2Sr2(CO3)3 by Materials Project. United States. doi:https://doi.org/10.17188/1311607
2020.
"Materials Data on Cs2Sr2(CO3)3 by Materials Project". United States. doi:https://doi.org/10.17188/1311607. https://www.osti.gov/servlets/purl/1311607. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1311607,
title = {Materials Data on Cs2Sr2(CO3)3 by Materials Project},
abstractNote = {Cs2Sr2(CO3)3 crystallizes in the cubic I2_13 space group. The structure is three-dimensional. Cs1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are three shorter (3.06 Å) and three longer (3.14 Å) Cs–O bond lengths. Sr2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Sr–O bond distances ranging from 2.58–3.06 Å. C4+ is bonded in a trigonal planar geometry to three O2- atoms. There is two shorter (1.30 Å) and one longer (1.31 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 two equivalent Cs1+, two equivalent Sr2+, and one C4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to one Cs1+, two equivalent Sr2+, and one C4+ atom.},
doi = {10.17188/1311607},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}