Materials Data on Tb(P3Ru)4 by Materials Project

doi:10.17188/1189479

Title: Materials Data on Tb(P3Ru)4 by Materials Project

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Abstract

TbRu4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Tb3+ is bonded to twelve equivalent P1- atoms to form TbP12 cuboctahedra that share faces with eight equivalent RuP6 octahedra. All Tb–P bond lengths are 3.11 Å. Ru+2.25+ is bonded to six equivalent P1- atoms to form RuP6 octahedra that share corners with six equivalent RuP6 octahedra and faces with two equivalent TbP12 cuboctahedra. The corner-sharing octahedral tilt angles are 62°. All Ru–P bond lengths are 2.36 Å. P1- is bonded in a 5-coordinate geometry to one Tb3+, two equivalent Ru+2.25+, and two equivalent P1- atoms. Both P–P bond lengths are 2.31 Å.

Publication Date:: Tue Jul 14 04:00:00 UTC 2020

Other Number(s):: mp-13245

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; P-Ru-Tb; Tb(P3Ru)4; crystal structure

OSTI Identifier:: 1189479

DOI:: https://doi.org/10.17188/1189479

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                    Materials Data on Tb(P3Ru)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1189479.

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                    Materials Data on Tb(P3Ru)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1189479

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                    2020.  
"Materials Data on Tb(P3Ru)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1189479.  https://www.osti.gov/servlets/purl/1189479. Pub date:Tue Jul 14 04:00:00 UTC 2020

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@article{osti_1189479,

  title        = {Materials Data on Tb(P3Ru)4 by Materials Project},

  
  abstractNote = {TbRu4P12 crystallizes in the cubic Im-3 space group. The structure is three-dimensional. Tb3+ is bonded to twelve equivalent P1- atoms to form TbP12 cuboctahedra that share faces with eight equivalent RuP6 octahedra. All Tb–P bond lengths are 3.11 Å. Ru+2.25+ is bonded to six equivalent P1- atoms to form RuP6 octahedra that share corners with six equivalent RuP6 octahedra and faces with two equivalent TbP12 cuboctahedra. The corner-sharing octahedral tilt angles are 62°. All Ru–P bond lengths are 2.36 Å. P1- is bonded in a 5-coordinate geometry to one Tb3+, two equivalent Ru+2.25+, and two equivalent P1- atoms. Both P–P bond lengths are 2.31 Å.},

  doi          = {10.17188/1189479},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jul 14 04:00:00 UTC 2020},

  month        = {Tue Jul 14 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1189479

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