Materials Data on ThSbSe by Materials Project

doi:10.17188/1350671

Title: Materials Data on ThSbSe by Materials Project

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Abstract

ThSbSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Th4+ is bonded in a 9-coordinate geometry to four equivalent Sb2- and five equivalent Se2- atoms. All Th–Sb bond lengths are 3.31 Å. There are one shorter (3.05 Å) and four longer (3.11 Å) Th–Se bond lengths. Sb2- is bonded in a 8-coordinate geometry to four equivalent Th4+ and four equivalent Sb2- atoms. All Sb–Sb bond lengths are 3.03 Å. Se2- is bonded to five equivalent Th4+ atoms to form a mixture of distorted edge and corner-sharing SeTh5 trigonal bipyramids.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-1019359

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; ThSbSe; Sb-Se-Th

OSTI Identifier:: 1350671

DOI:: https://doi.org/10.17188/1350671

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                    The Materials Project. Materials Data on ThSbSe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1350671.

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                    The Materials Project. Materials Data on ThSbSe by Materials Project.  United States.  doi:https://doi.org/10.17188/1350671

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                    The Materials Project. 2020.  
"Materials Data on ThSbSe by Materials Project".  United States.  doi:https://doi.org/10.17188/1350671.  https://www.osti.gov/servlets/purl/1350671. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1350671,

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

  author       = {The Materials Project},

  abstractNote = {ThSbSe is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Th4+ is bonded in a 9-coordinate geometry to four equivalent Sb2- and five equivalent Se2- atoms. All Th–Sb bond lengths are 3.31 Å. There are one shorter (3.05 Å) and four longer (3.11 Å) Th–Se bond lengths. Sb2- is bonded in a 8-coordinate geometry to four equivalent Th4+ and four equivalent Sb2- atoms. All Sb–Sb bond lengths are 3.03 Å. Se2- is bonded to five equivalent Th4+ atoms to form a mixture of distorted edge and corner-sharing SeTh5 trigonal bipyramids.},

  doi          = {10.17188/1350671},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1350671

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