Materials Data on Y6TeO12 by Materials Project

doi:10.17188/1289395

Title: Materials Data on Y6TeO12 by Materials Project

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Abstract

Y6TeO12 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Y3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Y–O bond distances ranging from 2.21–2.70 Å. Te6+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Te–O bond lengths are 1.97 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Y3+ and one Te6+ atom. In the second O2- site, O2- is bonded to four equivalent Y3+ atoms to form a mixture of edge and corner-sharing OY4 tetrahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-14

Other Number(s):: mp-754359

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; Y6TeO12; O-Te-Y

OSTI Identifier:: 1289395

DOI:: https://doi.org/10.17188/1289395

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                    The Materials Project. Materials Data on Y6TeO12 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1289395.

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                    The Materials Project. Materials Data on Y6TeO12 by Materials Project.  United States.  doi:https://doi.org/10.17188/1289395

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                    The Materials Project. 2020.  
"Materials Data on Y6TeO12 by Materials Project".  United States.  doi:https://doi.org/10.17188/1289395.  https://www.osti.gov/servlets/purl/1289395. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1289395,

  title        = {Materials Data on Y6TeO12 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Y6TeO12 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Y3+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Y–O bond distances ranging from 2.21–2.70 Å. Te6+ is bonded in an octahedral geometry to six equivalent O2- atoms. All Te–O bond lengths are 1.97 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to three equivalent Y3+ and one Te6+ atom. In the second O2- site, O2- is bonded to four equivalent Y3+ atoms to form a mixture of edge and corner-sharing OY4 tetrahedra.},

  doi          = {10.17188/1289395},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1289395

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