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Title: Materials Data on Ag3(AsO4)2 by Materials Project

Abstract

Ag3(AsO4)2 crystallizes in the trigonal R3 space group. The structure is three-dimensional. Ag2+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.17–2.25 Å. There are two inequivalent As5+ sites. In the first As5+ site, As5+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.66 Å) and three longer (1.77 Å) As–O bond length. In the second As5+ site, As5+ is bonded in a tetrahedral geometry to four O2- atoms. There is three shorter (1.71 Å) and one longer (1.85 Å) As–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ag2+ and one As5+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one As5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ag2+ and one As5+ atom. In the fourth O2- site, O2- is bonded in a tetrahedral geometry to three equivalent Ag2+ and one As5+ atom.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-35320
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; Ag3(AsO4)2; Ag-As-O
OSTI Identifier:
1206982
DOI:
10.17188/1206982

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Ag3(AsO4)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1206982.
Persson, Kristin, & Project, Materials. Materials Data on Ag3(AsO4)2 by Materials Project. United States. doi:10.17188/1206982.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Ag3(AsO4)2 by Materials Project". United States. doi:10.17188/1206982. https://www.osti.gov/servlets/purl/1206982. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1206982,
title = {Materials Data on Ag3(AsO4)2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Ag3(AsO4)2 crystallizes in the trigonal R3 space group. The structure is three-dimensional. Ag2+ is bonded in a rectangular see-saw-like geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.17–2.25 Å. There are two inequivalent As5+ sites. In the first As5+ site, As5+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.66 Å) and three longer (1.77 Å) As–O bond length. In the second As5+ site, As5+ is bonded in a tetrahedral geometry to four O2- atoms. There is three shorter (1.71 Å) and one longer (1.85 Å) As–O bond length. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Ag2+ and one As5+ atom. In the second O2- site, O2- is bonded in a single-bond geometry to one As5+ atom. In the third O2- site, O2- is bonded in a bent 120 degrees geometry to one Ag2+ and one As5+ atom. In the fourth O2- site, O2- is bonded in a tetrahedral geometry to three equivalent Ag2+ and one As5+ atom.},
doi = {10.17188/1206982},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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