Materials Data on Tl2(SbO3)3 by Materials Project

doi:10.17188/1204486

Title: Materials Data on Tl2(SbO3)3 by Materials Project

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Abstract

Tl2(SbO3)3 crystallizes in the cubic Pn-3 space group. The structure is three-dimensional. Tl is bonded in a 6-coordinate geometry to six O atoms. There are three shorter (2.70 Å) and three longer (2.86 Å) Tl–O bond lengths. Sb is bonded to six O atoms to form a mixture of edge and corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 53°. There are a spread of Sb–O bond distances ranging from 1.99–2.04 Å. There are two inequivalent O sites. In the first O site, O is bonded in a water-like geometry to two equivalent Tl and two equivalent Sb atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to one Tl and two equivalent Sb atoms.

Publication Date:: Thu Apr 30 04:00:00 UTC 2020

Other Number(s):: mp-30059

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; O-Sb-Tl; Tl2(SbO3)3; crystal structure

OSTI Identifier:: 1204486

DOI:: https://doi.org/10.17188/1204486

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                    Materials Data on Tl2(SbO3)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1204486.

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                    Materials Data on Tl2(SbO3)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1204486

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                    2020.  
"Materials Data on Tl2(SbO3)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1204486.  https://www.osti.gov/servlets/purl/1204486. Pub date:Thu Apr 30 04:00:00 UTC 2020

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@article{osti_1204486,

  title        = {Materials Data on Tl2(SbO3)3 by Materials Project},

  
  abstractNote = {Tl2(SbO3)3 crystallizes in the cubic Pn-3 space group. The structure is three-dimensional. Tl is bonded in a 6-coordinate geometry to six O atoms. There are three shorter (2.70 Å) and three longer (2.86 Å) Tl–O bond lengths. Sb is bonded to six O atoms to form a mixture of edge and corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 53°. There are a spread of Sb–O bond distances ranging from 1.99–2.04 Å. There are two inequivalent O sites. In the first O site, O is bonded in a water-like geometry to two equivalent Tl and two equivalent Sb atoms. In the second O site, O is bonded in a distorted trigonal planar geometry to one Tl and two equivalent Sb atoms.},

  doi          = {10.17188/1204486},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Apr 30 04:00:00 UTC 2020},

  month        = {Thu Apr 30 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1204486

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