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Title: Materials Data on Zr(SiO)2 by Materials Project

Abstract

Zr(SiO)2 crystallizes in the tetragonal I4_1/amd space group. The structure is zero-dimensional and consists of eight Zr(SiO)2 clusters. Zr4+ is bonded in a linear geometry to two equivalent O2- atoms. Both Zr–O bond lengths are 2.06 Å. Si is bonded in a single-bond geometry to one O2- atom. The Si–O bond length is 1.63 Å. O2- is bonded in a bent 150 degrees geometry to one Zr4+ and one Si atom.

Publication Date:
Other Number(s):
mp-1207496
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; Zr(SiO)2; O-Si-Zr
OSTI Identifier:
1663691
DOI:
https://doi.org/10.17188/1663691

Citation Formats

The Materials Project. Materials Data on Zr(SiO)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1663691.
The Materials Project. Materials Data on Zr(SiO)2 by Materials Project. United States. doi:https://doi.org/10.17188/1663691
The Materials Project. 2019. "Materials Data on Zr(SiO)2 by Materials Project". United States. doi:https://doi.org/10.17188/1663691. https://www.osti.gov/servlets/purl/1663691. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1663691,
title = {Materials Data on Zr(SiO)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Zr(SiO)2 crystallizes in the tetragonal I4_1/amd space group. The structure is zero-dimensional and consists of eight Zr(SiO)2 clusters. Zr4+ is bonded in a linear geometry to two equivalent O2- atoms. Both Zr–O bond lengths are 2.06 Å. Si is bonded in a single-bond geometry to one O2- atom. The Si–O bond length is 1.63 Å. O2- is bonded in a bent 150 degrees geometry to one Zr4+ and one Si atom.},
doi = {10.17188/1663691},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}