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Title: Materials Data on Ti2O3 by Materials Project

Abstract

Ti2O3 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of two Ti2O3 sheets oriented in the (0, 1, 0) direction. Ti3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Ti–O bond distances ranging from 1.84–2.11 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to three equivalent Ti3+ atoms. In the second O2- site, O2- is bonded in a bent 150 degrees geometry to two equivalent Ti3+ atoms.

Publication Date:
Other Number(s):
mp-1179268
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; Ti2O3; O-Ti
OSTI Identifier:
1677202
DOI:
https://doi.org/10.17188/1677202

Citation Formats

The Materials Project. Materials Data on Ti2O3 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1677202.
The Materials Project. Materials Data on Ti2O3 by Materials Project. United States. doi:https://doi.org/10.17188/1677202
The Materials Project. 2019. "Materials Data on Ti2O3 by Materials Project". United States. doi:https://doi.org/10.17188/1677202. https://www.osti.gov/servlets/purl/1677202. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1677202,
title = {Materials Data on Ti2O3 by Materials Project},
author = {The Materials Project},
abstractNote = {Ti2O3 crystallizes in the monoclinic C2/c space group. The structure is two-dimensional and consists of two Ti2O3 sheets oriented in the (0, 1, 0) direction. Ti3+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Ti–O bond distances ranging from 1.84–2.11 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to three equivalent Ti3+ atoms. In the second O2- site, O2- is bonded in a bent 150 degrees geometry to two equivalent Ti3+ atoms.},
doi = {10.17188/1677202},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}