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Title: Materials Data on Ag2H6PdS2(NO3)2 by Materials Project

Abstract

PdAg2(SO3)2(NH3)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional and consists of four ammonia molecules and one PdAg2(SO3)2 framework. In the PdAg2(SO3)2 framework, Pd4+ is bonded in a linear geometry to two equivalent S2- atoms. Both Pd–S bond lengths are 2.33 Å. Ag2+ is bonded to four O2- atoms to form distorted corner-sharing AgO4 trigonal pyramids. There are a spread of Ag–O bond distances ranging from 2.34–2.51 Å. S2- is bonded in a distorted trigonal non-coplanar geometry to one Pd4+ and three O2- atoms. There is two shorter (1.51 Å) and one longer (1.53 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Ag2+ and one S2- atom. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ag2+ and one S2- atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ag2+ and one S2- atom.

Publication Date:
Other Number(s):
mp-1202149
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; Ag2H6PdS2(NO3)2; Ag-H-N-O-Pd-S
OSTI Identifier:
1651482
DOI:
https://doi.org/10.17188/1651482

Citation Formats

The Materials Project. Materials Data on Ag2H6PdS2(NO3)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1651482.
The Materials Project. Materials Data on Ag2H6PdS2(NO3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1651482
The Materials Project. 2019. "Materials Data on Ag2H6PdS2(NO3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1651482. https://www.osti.gov/servlets/purl/1651482. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1651482,
title = {Materials Data on Ag2H6PdS2(NO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {PdAg2(SO3)2(NH3)2 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional and consists of four ammonia molecules and one PdAg2(SO3)2 framework. In the PdAg2(SO3)2 framework, Pd4+ is bonded in a linear geometry to two equivalent S2- atoms. Both Pd–S bond lengths are 2.33 Å. Ag2+ is bonded to four O2- atoms to form distorted corner-sharing AgO4 trigonal pyramids. There are a spread of Ag–O bond distances ranging from 2.34–2.51 Å. S2- is bonded in a distorted trigonal non-coplanar geometry to one Pd4+ and three O2- atoms. There is two shorter (1.51 Å) and one longer (1.53 Å) S–O bond length. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Ag2+ and one S2- atom. In the second O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Ag2+ and one S2- atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ag2+ and one S2- atom.},
doi = {10.17188/1651482},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}