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Title: Materials Data on INO3 by Materials Project

Abstract

IONO2 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is one-dimensional and consists of two IONO2 ribbons oriented in the (0, 0, 1) direction. N1+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of N–O bond distances ranging from 1.22–1.32 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one N1+ and one I5+ atom. The O–I bond length is 2.26 Å. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one N1+ and one I5+ atom. The O–I bond length is 2.22 Å. In the third O2- site, O2- is bonded in a single-bond geometry to one N1+ atom. I5+ is bonded in a linear geometry to two O2- atoms.

Authors:
Publication Date:
Other Number(s):
mp-754661
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; INO3; I-N-O
OSTI Identifier:
1289507
DOI:
https://doi.org/10.17188/1289507

Citation Formats

The Materials Project. Materials Data on INO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289507.
The Materials Project. Materials Data on INO3 by Materials Project. United States. doi:https://doi.org/10.17188/1289507
The Materials Project. 2020. "Materials Data on INO3 by Materials Project". United States. doi:https://doi.org/10.17188/1289507. https://www.osti.gov/servlets/purl/1289507. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1289507,
title = {Materials Data on INO3 by Materials Project},
author = {The Materials Project},
abstractNote = {IONO2 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is one-dimensional and consists of two IONO2 ribbons oriented in the (0, 0, 1) direction. N1+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of N–O bond distances ranging from 1.22–1.32 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one N1+ and one I5+ atom. The O–I bond length is 2.26 Å. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one N1+ and one I5+ atom. The O–I bond length is 2.22 Å. In the third O2- site, O2- is bonded in a single-bond geometry to one N1+ atom. I5+ is bonded in a linear geometry to two O2- atoms.},
doi = {10.17188/1289507},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}