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Title: Materials Data on Ag(CO)2 by Materials Project

Abstract

AgO2C2 crystallizes in the monoclinic C2/c space group. The structure is one-dimensional and consists of four AgO2C2 clusters and two AgO2C2 ribbons oriented in the (0, 0, 1) direction. In each AgO2C2 cluster, Ag2+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Ag–O bond distances ranging from 2.24–2.55 Å. There are two inequivalent C1+ sites. In the first C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. In the second C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ag2+ and one C1+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Ag2+ and one C1+ atom. In each AgO2C2 ribbon, Ag2+ 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 2.25–2.58 Å. There are two inequivalent C1+ sites. In the first C1+ site, C1+ is bonded in a single-bond geometrymore » to one O2- atom. The C–O bond length is 1.26 Å. In the second C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ag2+ and one C1+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ag2+ and one C1+ atom.« less

Publication Date:
Other Number(s):
mp-654937
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; Ag(CO)2; Ag-C-O
OSTI Identifier:
1184013
DOI:
10.17188/1184013

Citation Formats

The Materials Project. Materials Data on Ag(CO)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1184013.
The Materials Project. Materials Data on Ag(CO)2 by Materials Project. United States. doi:10.17188/1184013.
The Materials Project. 2020. "Materials Data on Ag(CO)2 by Materials Project". United States. doi:10.17188/1184013. https://www.osti.gov/servlets/purl/1184013. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1184013,
title = {Materials Data on Ag(CO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {AgO2C2 crystallizes in the monoclinic C2/c space group. The structure is one-dimensional and consists of four AgO2C2 clusters and two AgO2C2 ribbons oriented in the (0, 0, 1) direction. In each AgO2C2 cluster, Ag2+ is bonded in a 3-coordinate geometry to three O2- atoms. There are a spread of Ag–O bond distances ranging from 2.24–2.55 Å. There are two inequivalent C1+ sites. In the first C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. In the second C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ag2+ and one C1+ atom. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Ag2+ and one C1+ atom. In each AgO2C2 ribbon, Ag2+ 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 2.25–2.58 Å. There are two inequivalent C1+ sites. In the first C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. In the second C1+ site, C1+ is bonded in a single-bond geometry to one O2- atom. The C–O bond length is 1.26 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Ag2+ and one C1+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ag2+ and one C1+ atom.},
doi = {10.17188/1184013},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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