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Title: Materials Data on TeIrO6 by Materials Project

Abstract

IrTeO6 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ir is bonded to six O atoms to form IrO6 octahedra that share corners with six equivalent TeO6 octahedra. The corner-sharing octahedra tilt angles range from 42–44°. There is four shorter (1.93 Å) and two longer (1.94 Å) Ir–O bond length. Te is bonded to six O atoms to form TeO6 octahedra that share corners with six equivalent IrO6 octahedra. The corner-sharing octahedra tilt angles range from 42–44°. All Te–O bond lengths are 1.98 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom. In the second O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom. In the third O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom.

Authors:
Publication Date:
Other Number(s):
mvc-5679
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; TeIrO6; Ir-O-Te
OSTI Identifier:
1321483
DOI:
https://doi.org/10.17188/1321483

Citation Formats

The Materials Project. Materials Data on TeIrO6 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1321483.
The Materials Project. Materials Data on TeIrO6 by Materials Project. United States. doi:https://doi.org/10.17188/1321483
The Materials Project. 2020. "Materials Data on TeIrO6 by Materials Project". United States. doi:https://doi.org/10.17188/1321483. https://www.osti.gov/servlets/purl/1321483. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1321483,
title = {Materials Data on TeIrO6 by Materials Project},
author = {The Materials Project},
abstractNote = {IrTeO6 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ir is bonded to six O atoms to form IrO6 octahedra that share corners with six equivalent TeO6 octahedra. The corner-sharing octahedra tilt angles range from 42–44°. There is four shorter (1.93 Å) and two longer (1.94 Å) Ir–O bond length. Te is bonded to six O atoms to form TeO6 octahedra that share corners with six equivalent IrO6 octahedra. The corner-sharing octahedra tilt angles range from 42–44°. All Te–O bond lengths are 1.98 Å. There are three inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom. In the second O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom. In the third O site, O is bonded in a bent 150 degrees geometry to one Ir and one Te atom.},
doi = {10.17188/1321483},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}