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Title: Materials Data on Ag2Te(H2O3)2 by Materials Project

Abstract

Ag2Te(H2O3)2 crystallizes in the orthorhombic Fdd2 space group. The structure is three-dimensional. Ag1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.26–2.65 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.64 Å) H–O bond length. In the second H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.59 Å) H–O bond length. Te6+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Te–O bond distances ranging from 1.91–2.00 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Ag1+, one H1+, and one Te6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Ag1+, one H1+, and one Te6+ atom. In the third O2- site, O2- is bonded to one Ag1+, two H1+, and one Te6+ atom to form distorted corner-sharing OAgTeH2 tetrahedra.

Publication Date:
Other Number(s):
mp-1193238
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; Ag2Te(H2O3)2; Ag-H-O-Te
OSTI Identifier:
1677218
DOI:
https://doi.org/10.17188/1677218

Citation Formats

The Materials Project. Materials Data on Ag2Te(H2O3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1677218.
The Materials Project. Materials Data on Ag2Te(H2O3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1677218
The Materials Project. 2020. "Materials Data on Ag2Te(H2O3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1677218. https://www.osti.gov/servlets/purl/1677218. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1677218,
title = {Materials Data on Ag2Te(H2O3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Ag2Te(H2O3)2 crystallizes in the orthorhombic Fdd2 space group. The structure is three-dimensional. Ag1+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Ag–O bond distances ranging from 2.26–2.65 Å. There are two inequivalent H1+ sites. In the first H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.64 Å) H–O bond length. In the second H1+ site, H1+ is bonded in a distorted linear geometry to two O2- atoms. There is one shorter (1.02 Å) and one longer (1.59 Å) H–O bond length. Te6+ is bonded in an octahedral geometry to six O2- atoms. There are a spread of Te–O bond distances ranging from 1.91–2.00 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Ag1+, one H1+, and one Te6+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Ag1+, one H1+, and one Te6+ atom. In the third O2- site, O2- is bonded to one Ag1+, two H1+, and one Te6+ atom to form distorted corner-sharing OAgTeH2 tetrahedra.},
doi = {10.17188/1677218},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}