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Title: Materials Data on ZnTeO3 by Materials Project

Abstract

ZnTeO3 is Antimony trioxide-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Zn2+ is bonded to five O2- atoms to form a mixture of distorted corner and edge-sharing ZnO5 trigonal bipyramids. There are a spread of Zn–O bond distances ranging from 2.00–2.31 Å. Te4+ is bonded in a 3-coordinate geometry to three O2- atoms. There is two shorter (1.91 Å) and one longer (1.92 Å) Te–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 Zn2+ and one Te4+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Zn2+ and one Te4+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Zn2+ and one Te4+ atom.

Authors:
Publication Date:
Other Number(s):
mp-16819
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; ZnTeO3; O-Te-Zn
OSTI Identifier:
1192187
DOI:
https://doi.org/10.17188/1192187

Citation Formats

The Materials Project. Materials Data on ZnTeO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192187.
The Materials Project. Materials Data on ZnTeO3 by Materials Project. United States. doi:https://doi.org/10.17188/1192187
The Materials Project. 2020. "Materials Data on ZnTeO3 by Materials Project". United States. doi:https://doi.org/10.17188/1192187. https://www.osti.gov/servlets/purl/1192187. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1192187,
title = {Materials Data on ZnTeO3 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnTeO3 is Antimony trioxide-derived structured and crystallizes in the orthorhombic Pbca space group. The structure is three-dimensional. Zn2+ is bonded to five O2- atoms to form a mixture of distorted corner and edge-sharing ZnO5 trigonal bipyramids. There are a spread of Zn–O bond distances ranging from 2.00–2.31 Å. Te4+ is bonded in a 3-coordinate geometry to three O2- atoms. There is two shorter (1.91 Å) and one longer (1.92 Å) Te–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 Zn2+ and one Te4+ atom. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Zn2+ and one Te4+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Zn2+ and one Te4+ atom.},
doi = {10.17188/1192187},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}