U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on IO3 by Materials Project
Abstract
IO3 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is three-dimensional. there are three inequivalent O sites. In the first O site, O is bonded in a 2-coordinate geometry to two equivalent I atoms. There are one shorter (1.85 Å) and one longer (2.40 Å) O–I bond lengths. In the second O site, O is bonded in a distorted bent 150 degrees geometry to two equivalent I atoms. There are one shorter (1.87 Å) and one longer (2.20 Å) O–I bond lengths. In the third O site, O is bonded in a distorted bent 120 degrees geometry to two equivalent I atoms. There are one shorter (1.89 Å) and one longer (2.20 Å) O–I bond lengths. I is bonded to six O atoms to form distorted corner-sharing IO6 octahedra. The corner-sharing octahedra tilt angles range from 45–47°.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1181185
- 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; IO3; I-O
- OSTI Identifier:
- 1731861
- DOI:
- https://doi.org/10.17188/1731861
Citation Formats
The Materials Project. Materials Data on IO3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1731861.
The Materials Project. Materials Data on IO3 by Materials Project. United States. doi:https://doi.org/10.17188/1731861
The Materials Project. 2020.
"Materials Data on IO3 by Materials Project". United States. doi:https://doi.org/10.17188/1731861. https://www.osti.gov/servlets/purl/1731861. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1731861,
title = {Materials Data on IO3 by Materials Project},
author = {The Materials Project},
abstractNote = {IO3 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is three-dimensional. there are three inequivalent O sites. In the first O site, O is bonded in a 2-coordinate geometry to two equivalent I atoms. There are one shorter (1.85 Å) and one longer (2.40 Å) O–I bond lengths. In the second O site, O is bonded in a distorted bent 150 degrees geometry to two equivalent I atoms. There are one shorter (1.87 Å) and one longer (2.20 Å) O–I bond lengths. In the third O site, O is bonded in a distorted bent 120 degrees geometry to two equivalent I atoms. There are one shorter (1.89 Å) and one longer (2.20 Å) O–I bond lengths. I is bonded to six O atoms to form distorted corner-sharing IO6 octahedra. The corner-sharing octahedra tilt angles range from 45–47°.},
doi = {10.17188/1731861},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}