Materials Data on TaPbSe2 by Materials Project

doi:10.17188/1274020

Title: Materials Data on TaPbSe2 by Materials Project

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Abstract

PbTaSe2 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ta is bonded to six equivalent Se atoms to form distorted edge-sharing TaSe6 pentagonal pyramids. All Ta–Se bond lengths are 2.61 Å. Pb is bonded in a distorted linear geometry to two equivalent Se atoms. Both Pb–Se bond lengths are 3.08 Å. Se is bonded in a 4-coordinate geometry to three equivalent Ta and one Pb atom.

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-567736

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; TaPbSe2; Pb-Se-Ta

OSTI Identifier:: 1274020

DOI:: https://doi.org/10.17188/1274020

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                    The Materials Project. Materials Data on TaPbSe2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1274020.

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                    The Materials Project. Materials Data on TaPbSe2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1274020

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                    The Materials Project. 2020.  
"Materials Data on TaPbSe2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1274020.  https://www.osti.gov/servlets/purl/1274020. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1274020,

  title        = {Materials Data on TaPbSe2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PbTaSe2 crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Ta is bonded to six equivalent Se atoms to form distorted edge-sharing TaSe6 pentagonal pyramids. All Ta–Se bond lengths are 2.61 Å. Pb is bonded in a distorted linear geometry to two equivalent Se atoms. Both Pb–Se bond lengths are 3.08 Å. Se is bonded in a 4-coordinate geometry to three equivalent Ta and one Pb atom.},

  doi          = {10.17188/1274020},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1274020

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