Materials Data on IrO3 by Materials Project
Abstract
IrO3 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. Ir is bonded to six O atoms to form corner-sharing IrO6 octahedra. The corner-sharing octahedra tilt angles range from 2–41°. There are a spread of Ir–O bond distances ranging from 1.88–1.97 Å. There are four inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the second O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the third O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the fourth O site, O is bonded in a linear geometry to two equivalent Ir atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1022963
- 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; IrO3; Ir-O
- OSTI Identifier:
- 1354966
- DOI:
- https://doi.org/10.17188/1354966
Citation Formats
The Materials Project. Materials Data on IrO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1354966.
The Materials Project. Materials Data on IrO3 by Materials Project. United States. doi:https://doi.org/10.17188/1354966
The Materials Project. 2020.
"Materials Data on IrO3 by Materials Project". United States. doi:https://doi.org/10.17188/1354966. https://www.osti.gov/servlets/purl/1354966. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1354966,
title = {Materials Data on IrO3 by Materials Project},
author = {The Materials Project},
abstractNote = {IrO3 crystallizes in the orthorhombic Amm2 space group. The structure is three-dimensional. Ir is bonded to six O atoms to form corner-sharing IrO6 octahedra. The corner-sharing octahedra tilt angles range from 2–41°. There are a spread of Ir–O bond distances ranging from 1.88–1.97 Å. There are four inequivalent O sites. In the first O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the second O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the third O site, O is bonded in a bent 150 degrees geometry to two equivalent Ir atoms. In the fourth O site, O is bonded in a linear geometry to two equivalent Ir atoms.},
doi = {10.17188/1354966},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 23 00:00:00 EDT 2020},
month = {Thu Jul 23 00:00:00 EDT 2020}
}
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