Materials Data on ZnTe2O5 by Materials Project
Abstract
ZnTe2O5 crystallizes in the tetragonal P4_2/nbc space group. The structure is three-dimensional. there are two inequivalent Zn2+ sites. In the first Zn2+ site, Zn2+ is bonded in a distorted octahedral geometry to six O2- atoms. There are four shorter (2.06 Å) and two longer (2.48 Å) Zn–O bond lengths. In the second Zn2+ site, Zn2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.22 Å) and four longer (2.39 Å) Zn–O bond lengths. Te4+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.92–2.24 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to one Zn2+ and two equivalent Te4+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to one Zn2+ and two equivalent Te4+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Zn2+ and one Te4+ atom.
- Authors:
- Publication Date:
- 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)
- Contributing Org.:
- MIT; UC Berkeley; Duke; U Louvain
- OSTI Identifier:
- 1306456
- Report Number(s):
- mp-779698
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Resource Type:
- Data
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; ZnTe2O5; O-Te-Zn
Citation Formats
The Materials Project. Materials Data on ZnTe2O5 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1306456.
The Materials Project. Materials Data on ZnTe2O5 by Materials Project. United States. https://doi.org/10.17188/1306456
The Materials Project. 2020.
"Materials Data on ZnTe2O5 by Materials Project". United States. https://doi.org/10.17188/1306456. https://www.osti.gov/servlets/purl/1306456.
@article{osti_1306456,
title = {Materials Data on ZnTe2O5 by Materials Project},
author = {The Materials Project},
abstractNote = {ZnTe2O5 crystallizes in the tetragonal P4_2/nbc space group. The structure is three-dimensional. there are two inequivalent Zn2+ sites. In the first Zn2+ site, Zn2+ is bonded in a distorted octahedral geometry to six O2- atoms. There are four shorter (2.06 Å) and two longer (2.48 Å) Zn–O bond lengths. In the second Zn2+ site, Zn2+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are four shorter (2.22 Å) and four longer (2.39 Å) Zn–O bond lengths. Te4+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.92–2.24 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to one Zn2+ and two equivalent Te4+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to one Zn2+ and two equivalent Te4+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Zn2+ and one Te4+ atom.},
doi = {10.17188/1306456},
url = {https://www.osti.gov/biblio/1306456},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Wed Apr 29 00:00:00 EDT 2020},
month = {Wed Apr 29 00:00:00 EDT 2020}
}