U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Cu2AgO4 by Materials Project
Abstract
AgCu2O4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Ag3+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.12 Å) and two longer (2.14 Å) Ag–O bond lengths. There are two inequivalent Cu+2.50+ sites. In the first Cu+2.50+ site, Cu+2.50+ is bonded in a square co-planar geometry to four O2- atoms. All Cu–O bond lengths are 1.87 Å. In the second Cu+2.50+ site, Cu+2.50+ is bonded in a square co-planar geometry to four O2- atoms. There is two shorter (1.84 Å) and two longer (1.85 Å) Cu–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a trigonal non-coplanar geometry to one Ag3+ and two Cu+2.50+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Ag3+ and two Cu+2.50+ atoms.
- Publication Date:
- Other Number(s):
- mp-1225882
- 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; Ag-Cu-O; Cu2AgO4; crystal structure
- OSTI Identifier:
- 1651639
- DOI:
- https://doi.org/10.17188/1651639
Citation Formats
Materials Data on Cu2AgO4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1651639.
Materials Data on Cu2AgO4 by Materials Project. United States. doi:https://doi.org/10.17188/1651639
2020.
"Materials Data on Cu2AgO4 by Materials Project". United States. doi:https://doi.org/10.17188/1651639. https://www.osti.gov/servlets/purl/1651639. Pub date:Thu Jul 23 04:00:00 UTC 2020
@article{osti_1651639,
title = {Materials Data on Cu2AgO4 by Materials Project},
abstractNote = {AgCu2O4 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Ag3+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.12 Å) and two longer (2.14 Å) Ag–O bond lengths. There are two inequivalent Cu+2.50+ sites. In the first Cu+2.50+ site, Cu+2.50+ is bonded in a square co-planar geometry to four O2- atoms. All Cu–O bond lengths are 1.87 Å. In the second Cu+2.50+ site, Cu+2.50+ is bonded in a square co-planar geometry to four O2- atoms. There is two shorter (1.84 Å) and two longer (1.85 Å) Cu–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a trigonal non-coplanar geometry to one Ag3+ and two Cu+2.50+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to one Ag3+ and two Cu+2.50+ atoms.},
doi = {10.17188/1651639},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}