U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ag2P2PdO7 by Materials Project
Abstract
PdAg2P2O7 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Pd2+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.04 Å) and two longer (2.05 Å) Pd–O bond lengths. Ag1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ag–O bond distances ranging from 2.36–2.76 Å. P5+ is bonded to four O2- atoms to form corner-sharing PO4 tetrahedra. There are a spread of P–O bond distances ranging from 1.52–1.63 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to three equivalent Ag1+ and one P5+ atom. In the second O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent P5+ atoms. In the third O2- site, O2- is bonded in a 1-coordinate geometry to one Pd2+, two equivalent Ag1+, and one P5+ atom. In the fourth O2- site, O2- is bonded in a distorted trigonal planar geometry to one Pd2+, one Ag1+, and one P5+ atom.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1190325
- 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; Ag2P2PdO7; Ag-O-P-Pd
- OSTI Identifier:
- 1663616
- DOI:
- https://doi.org/10.17188/1663616
Citation Formats
The Materials Project. Materials Data on Ag2P2PdO7 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1663616.
The Materials Project. Materials Data on Ag2P2PdO7 by Materials Project. United States. doi:https://doi.org/10.17188/1663616
The Materials Project. 2020.
"Materials Data on Ag2P2PdO7 by Materials Project". United States. doi:https://doi.org/10.17188/1663616. https://www.osti.gov/servlets/purl/1663616. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1663616,
title = {Materials Data on Ag2P2PdO7 by Materials Project},
author = {The Materials Project},
abstractNote = {PdAg2P2O7 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Pd2+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.04 Å) and two longer (2.05 Å) Pd–O bond lengths. Ag1+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ag–O bond distances ranging from 2.36–2.76 Å. P5+ is bonded to four O2- atoms to form corner-sharing PO4 tetrahedra. There are a spread of P–O bond distances ranging from 1.52–1.63 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to three equivalent Ag1+ and one P5+ atom. In the second O2- site, O2- is bonded in a bent 120 degrees geometry to two equivalent P5+ atoms. In the third O2- site, O2- is bonded in a 1-coordinate geometry to one Pd2+, two equivalent Ag1+, and one P5+ atom. In the fourth O2- site, O2- is bonded in a distorted trigonal planar geometry to one Pd2+, one Ag1+, and one P5+ atom.},
doi = {10.17188/1663616},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}