Materials Data on TlSbSe2 by Materials Project

doi:10.17188/1195039

Title: Materials Data on TlSbSe2 by Materials Project

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Abstract

TlSbSe2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Tl1+ is bonded to four equivalent Sb3+ and two equivalent Se2- atoms to form a mixture of corner and edge-sharing TlSb4Se2 octahedra. The corner-sharing octahedral tilt angles are 0°. All Tl–Sb bond lengths are 3.03 Å. Both Tl–Se bond lengths are 3.26 Å. Sb3+ is bonded in a square co-planar geometry to four equivalent Tl1+ atoms. Se2- is bonded in a distorted trigonal planar geometry to one Tl1+ and two equivalent Se2- atoms. Both Se–Se bond lengths are 2.43 Å.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-19846

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; TlSbSe2; Sb-Se-Tl

OSTI Identifier:: 1195039

DOI:: https://doi.org/10.17188/1195039

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                    The Materials Project. Materials Data on TlSbSe2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1195039.

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                    The Materials Project. Materials Data on TlSbSe2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1195039

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                    The Materials Project. 2020.  
"Materials Data on TlSbSe2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1195039.  https://www.osti.gov/servlets/purl/1195039. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1195039,

  title        = {Materials Data on TlSbSe2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TlSbSe2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Tl1+ is bonded to four equivalent Sb3+ and two equivalent Se2- atoms to form a mixture of corner and edge-sharing TlSb4Se2 octahedra. The corner-sharing octahedral tilt angles are 0°. All Tl–Sb bond lengths are 3.03 Å. Both Tl–Se bond lengths are 3.26 Å. Sb3+ is bonded in a square co-planar geometry to four equivalent Tl1+ atoms. Se2- is bonded in a distorted trigonal planar geometry to one Tl1+ and two equivalent Se2- atoms. Both Se–Se bond lengths are 2.43 Å.},

  doi          = {10.17188/1195039},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1195039

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