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Title: Materials Data on Ti(HO)2 by Materials Project

Abstract

Ti(OH)2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Ti2+ is bonded to six equivalent O2- atoms to form a mixture of distorted edge and corner-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles are 49°. There are four shorter (2.20 Å) and two longer (2.25 Å) Ti–O bond lengths. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. O2- is bonded in a distorted single-bond geometry to three equivalent Ti2+ and one H1+ atom.

Authors:
Publication Date:
Other Number(s):
mp-1094046
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; Ti(HO)2; H-O-Ti
OSTI Identifier:
1705873
DOI:
https://doi.org/10.17188/1705873

Citation Formats

The Materials Project. Materials Data on Ti(HO)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1705873.
The Materials Project. Materials Data on Ti(HO)2 by Materials Project. United States. doi:https://doi.org/10.17188/1705873
The Materials Project. 2020. "Materials Data on Ti(HO)2 by Materials Project". United States. doi:https://doi.org/10.17188/1705873. https://www.osti.gov/servlets/purl/1705873. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1705873,
title = {Materials Data on Ti(HO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Ti(OH)2 crystallizes in the orthorhombic Pnnm space group. The structure is three-dimensional. Ti2+ is bonded to six equivalent O2- atoms to form a mixture of distorted edge and corner-sharing TiO6 octahedra. The corner-sharing octahedral tilt angles are 49°. There are four shorter (2.20 Å) and two longer (2.25 Å) Ti–O bond lengths. H1+ is bonded in a single-bond geometry to one O2- atom. The H–O bond length is 0.99 Å. O2- is bonded in a distorted single-bond geometry to three equivalent Ti2+ and one H1+ atom.},
doi = {10.17188/1705873},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}