Materials Data on Zr(SiO)2 by Materials Project

doi:10.17188/1663691

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

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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.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1207496

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; Zr(SiO)2; O-Si-Zr

OSTI Identifier:: 1663691

DOI:: https://doi.org/10.17188/1663691

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                    The Materials Project. Materials Data on Zr(SiO)2 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1663691.

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                    The Materials Project. Materials Data on Zr(SiO)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1663691

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                    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

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@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}

}

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DOI: https://doi.org/10.17188/1663691

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