Materials Data on TaTl3Se4 by Materials Project

doi:10.17188/1187253

Title: Materials Data on TaTl3Se4 by Materials Project

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Abstract

Tl3TaSe4 crystallizes in the cubic I-43m space group. The structure is three-dimensional and consists of two Tl3TaSe4 frameworks. Ta5+ is bonded in a tetrahedral geometry to four equivalent Se2- atoms. All Ta–Se bond lengths are 2.42 Å. Tl1+ is bonded in a 8-coordinate geometry to four equivalent Se2- atoms. All Tl–Se bond lengths are 3.29 Å. Se2- is bonded in a distorted single-bond geometry to one Ta5+ and three equivalent Tl1+ atoms.

Publication Date:: 2020-07-15

Other Number(s):: mp-10644

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; crystal structure; Se-Ta-Tl; TaTl3Se4

OSTI Identifier:: 1187253

DOI:: https://doi.org/10.17188/1187253

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                    Materials Data on TaTl3Se4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187253.

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                    Materials Data on TaTl3Se4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187253

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                    2020.  
"Materials Data on TaTl3Se4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187253.  https://www.osti.gov/servlets/purl/1187253. Pub date:Wed Jul 15 20:00:00 EDT 2020

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@article{osti_1187253,

  title        = {Materials Data on TaTl3Se4 by Materials Project},

  
  abstractNote = {Tl3TaSe4 crystallizes in the cubic I-43m space group. The structure is three-dimensional and consists of two Tl3TaSe4 frameworks. Ta5+ is bonded in a tetrahedral geometry to four equivalent Se2- atoms. All Ta–Se bond lengths are 2.42 Å. Tl1+ is bonded in a 8-coordinate geometry to four equivalent Se2- atoms. All Tl–Se bond lengths are 3.29 Å. Se2- is bonded in a distorted single-bond geometry to one Ta5+ and three equivalent Tl1+ atoms.},

  doi          = {10.17188/1187253},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1187253

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