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Title: Materials Data on AgPdO3 by Materials Project

Abstract

PdAgO3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pd4+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.05 Å) and two longer (2.06 Å) Pd–O bond lengths. There are two inequivalent Ag2+ sites. In the first Ag2+ site, Ag2+ is bonded to six O2- atoms to form edge-sharing AgO6 octahedra. There are a spread of Ag–O bond distances ranging from 2.07–2.47 Å. In the second Ag2+ site, Ag2+ is bonded in a distorted L-shaped geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Pd4+ and one O2- atom. The O–O bond length is 1.39 Å. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ag2+ and one O2- atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pd4+ and two equivalent Ag2+ atoms.

Publication Date:
Other Number(s):
mp-776166
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; AgPdO3; Ag-O-Pd
OSTI Identifier:
1304156
DOI:
https://doi.org/10.17188/1304156

Citation Formats

The Materials Project. Materials Data on AgPdO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1304156.
The Materials Project. Materials Data on AgPdO3 by Materials Project. United States. doi:https://doi.org/10.17188/1304156
The Materials Project. 2020. "Materials Data on AgPdO3 by Materials Project". United States. doi:https://doi.org/10.17188/1304156. https://www.osti.gov/servlets/purl/1304156. Pub date:Wed Apr 29 00:00:00 EDT 2020
@article{osti_1304156,
title = {Materials Data on AgPdO3 by Materials Project},
author = {The Materials Project},
abstractNote = {PdAgO3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Pd4+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.05 Å) and two longer (2.06 Å) Pd–O bond lengths. There are two inequivalent Ag2+ sites. In the first Ag2+ site, Ag2+ is bonded to six O2- atoms to form edge-sharing AgO6 octahedra. There are a spread of Ag–O bond distances ranging from 2.07–2.47 Å. In the second Ag2+ site, Ag2+ is bonded in a distorted L-shaped geometry to two equivalent O2- atoms. Both Ag–O bond lengths are 2.25 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Pd4+ and one O2- atom. The O–O bond length is 1.39 Å. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ag2+ and one O2- atom. In the third O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Pd4+ and two equivalent Ag2+ atoms.},
doi = {10.17188/1304156},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}