Materials Data on CeTl2InSe4 by Materials Project

doi:10.17188/1677891

Title: Materials Data on CeTl2InSe4 by Materials Project

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Abstract

CeTl2InSe4 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Ce3+ is bonded to four equivalent Se2- atoms to form distorted CeSe4 tetrahedra that share edges with two equivalent InSe4 tetrahedra. All Ce–Se bond lengths are 2.92 Å. Tl1+ is bonded in a 8-coordinate geometry to eight equivalent Se2- atoms. There are four shorter (3.36 Å) and four longer (3.57 Å) Tl–Se bond lengths. In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share edges with two equivalent CeSe4 tetrahedra. All In–Se bond lengths are 2.65 Å. Se2- is bonded in a 2-coordinate geometry to one Ce3+, four equivalent Tl1+, and one In3+ atom.

Authors:: The Materials Project

Publication Date:: 2019-01-13

Other Number(s):: mp-1227269

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; CeTl2InSe4; Ce-In-Se-Tl

OSTI Identifier:: 1677891

DOI:: https://doi.org/10.17188/1677891

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                    The Materials Project. Materials Data on CeTl2InSe4 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1677891.

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                    The Materials Project. Materials Data on CeTl2InSe4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1677891

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                    The Materials Project. 2019.  
"Materials Data on CeTl2InSe4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1677891.  https://www.osti.gov/servlets/purl/1677891. Pub date:Sun Jan 13 00:00:00 EST 2019

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@article{osti_1677891,

  title        = {Materials Data on CeTl2InSe4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CeTl2InSe4 crystallizes in the tetragonal I-42m space group. The structure is three-dimensional. Ce3+ is bonded to four equivalent Se2- atoms to form distorted CeSe4 tetrahedra that share edges with two equivalent InSe4 tetrahedra. All Ce–Se bond lengths are 2.92 Å. Tl1+ is bonded in a 8-coordinate geometry to eight equivalent Se2- atoms. There are four shorter (3.36 Å) and four longer (3.57 Å) Tl–Se bond lengths. In3+ is bonded to four equivalent Se2- atoms to form InSe4 tetrahedra that share edges with two equivalent CeSe4 tetrahedra. All In–Se bond lengths are 2.65 Å. Se2- is bonded in a 2-coordinate geometry to one Ce3+, four equivalent Tl1+, and one In3+ atom.},

  doi          = {10.17188/1677891},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1677891

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