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Title: Materials Data on InCoO3 by Materials Project

Abstract

CoInO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Co3+ is bonded to six O2- atoms to form corner-sharing CoO6 octahedra. The corner-sharing octahedra tilt angles range from 36–39°. There is four shorter (1.94 Å) and two longer (1.97 Å) Co–O bond length. In3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of In–O bond distances ranging from 2.15–2.69 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Co3+ and two equivalent In3+ atoms to form distorted corner-sharing OIn2Co2 trigonal pyramids. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Co3+ and three equivalent In3+ atoms.

Publication Date:
Other Number(s):
mp-769897
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; InCoO3; Co-In-O
OSTI Identifier:
1299284
DOI:
10.17188/1299284

Citation Formats

The Materials Project. Materials Data on InCoO3 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1299284.
The Materials Project. Materials Data on InCoO3 by Materials Project. United States. doi:10.17188/1299284.
The Materials Project. 2017. "Materials Data on InCoO3 by Materials Project". United States. doi:10.17188/1299284. https://www.osti.gov/servlets/purl/1299284. Pub date:Wed May 10 00:00:00 EDT 2017
@article{osti_1299284,
title = {Materials Data on InCoO3 by Materials Project},
author = {The Materials Project},
abstractNote = {CoInO3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Co3+ is bonded to six O2- atoms to form corner-sharing CoO6 octahedra. The corner-sharing octahedra tilt angles range from 36–39°. There is four shorter (1.94 Å) and two longer (1.97 Å) Co–O bond length. In3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of In–O bond distances ranging from 2.15–2.69 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Co3+ and two equivalent In3+ atoms to form distorted corner-sharing OIn2Co2 trigonal pyramids. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Co3+ and three equivalent In3+ atoms.},
doi = {10.17188/1299284},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}

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