U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ag2CO3 by Materials Project
Abstract
Ag2CO3 crystallizes in the hexagonal P-6 space group. The structure is three-dimensional. there are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.23–2.55 Å. In the second Ag1+ site, Ag1+ is bonded to five O2- atoms to form edge-sharing AgO5 trigonal bipyramids. There are a spread of Ag–O bond distances ranging from 2.38–2.50 Å. There are three inequivalent C4+ sites. In the first C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. In the second C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. In the third C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.31 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to three Ag1+ and one C4+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to three Ag1+ andmore »
- Authors:
- Publication Date:
- Other Number(s):
- mp-1229177
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; Ag2CO3; Ag-C-O
- OSTI Identifier:
- 1681700
- DOI:
- https://doi.org/10.17188/1681700
Citation Formats
The Materials Project. Materials Data on Ag2CO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1681700.
The Materials Project. Materials Data on Ag2CO3 by Materials Project. United States. doi:https://doi.org/10.17188/1681700
The Materials Project. 2020.
"Materials Data on Ag2CO3 by Materials Project". United States. doi:https://doi.org/10.17188/1681700. https://www.osti.gov/servlets/purl/1681700. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1681700,
title = {Materials Data on Ag2CO3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ag2CO3 crystallizes in the hexagonal P-6 space group. The structure is three-dimensional. there are two inequivalent Ag1+ sites. In the first Ag1+ site, Ag1+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.23–2.55 Å. In the second Ag1+ site, Ag1+ is bonded to five O2- atoms to form edge-sharing AgO5 trigonal bipyramids. There are a spread of Ag–O bond distances ranging from 2.38–2.50 Å. There are three inequivalent C4+ sites. In the first C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. In the second C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.30 Å. In the third C4+ site, C4+ is bonded in a trigonal planar geometry to three equivalent O2- atoms. All C–O bond lengths are 1.31 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to three Ag1+ and one C4+ atom. In the second O2- site, O2- is bonded in a 1-coordinate geometry to three Ag1+ and one C4+ atom. In the third O2- site, O2- is bonded in a distorted single-bond geometry to three Ag1+ and one C4+ atom.},
doi = {10.17188/1681700},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}