Materials Data on NbTl3Se4 by Materials Project

doi:10.17188/1355283

Title: Materials Data on NbTl3Se4 by Materials Project

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Abstract

NbTl3Se4 crystallizes in the cubic I-43m space group. The structure is three-dimensional and consists of two NbTl3Se4 frameworks. Nb5+ is bonded in a tetrahedral geometry to four equivalent Se2- atoms. All Nb–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 3.30 Å. Se2- is bonded in a 1-coordinate geometry to one Nb5+ and three equivalent Tl1+ atoms.

Publication Date:: 2020-05-09

Other Number(s):: mp-1025396

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; Nb-Se-Tl; NbTl3Se4; crystal structure

OSTI Identifier:: 1355283

DOI:: https://doi.org/10.17188/1355283

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                    Materials Data on NbTl3Se4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1355283.

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                    Materials Data on NbTl3Se4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1355283

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                    2020.  
"Materials Data on NbTl3Se4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1355283.  https://www.osti.gov/servlets/purl/1355283. Pub date:Sat May 09 00:00:00 EDT 2020

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@article{osti_1355283,

  title        = {Materials Data on NbTl3Se4 by Materials Project},

  
  abstractNote = {NbTl3Se4 crystallizes in the cubic I-43m space group. The structure is three-dimensional and consists of two NbTl3Se4 frameworks. Nb5+ is bonded in a tetrahedral geometry to four equivalent Se2- atoms. All Nb–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 3.30 Å. Se2- is bonded in a 1-coordinate geometry to one Nb5+ and three equivalent Tl1+ atoms.},

  doi          = {10.17188/1355283},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1355283

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