Materials Data on TiTeSe by Materials Project

doi:10.17188/1651661

Title: Materials Data on TiTeSe by Materials Project

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Abstract

TiTeSe crystallizes in the trigonal P3m1 space group. The structure is two-dimensional and consists of one TiTeSe sheet oriented in the (0, 0, 1) direction. Ti4+ is bonded to three equivalent Te2- and three equivalent Se2- atoms to form edge-sharing TiTe3Se3 octahedra. All Ti–Te bond lengths are 2.80 Å. All Ti–Se bond lengths are 2.54 Å. Te2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms. Se2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms.

Publication Date:: 2019-01-12

Other Number(s):: mp-1216648

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; Se-Te-Ti; TiTeSe; crystal structure

OSTI Identifier:: 1651661

DOI:: https://doi.org/10.17188/1651661

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                    Materials Data on TiTeSe by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1651661.

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                    Materials Data on TiTeSe by Materials Project.  United States.  doi:https://doi.org/10.17188/1651661

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                    2019.  
"Materials Data on TiTeSe by Materials Project".  United States.  doi:https://doi.org/10.17188/1651661.  https://www.osti.gov/servlets/purl/1651661. Pub date:Sat Jan 12 04:00:00 UTC 2019

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@article{osti_1651661,

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

  
  abstractNote = {TiTeSe crystallizes in the trigonal P3m1 space group. The structure is two-dimensional and consists of one TiTeSe sheet oriented in the (0, 0, 1) direction. Ti4+ is bonded to three equivalent Te2- and three equivalent Se2- atoms to form edge-sharing TiTe3Se3 octahedra. All Ti–Te bond lengths are 2.80 Å. All Ti–Se bond lengths are 2.54 Å. Te2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms. Se2- is bonded in a 3-coordinate geometry to three equivalent Ti4+ atoms.},

  doi          = {10.17188/1651661},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1651661

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