Materials Data on Pr(Sb3Os)4 by Materials Project

doi:10.17188/1208003

Title: Materials Data on Pr(Sb3Os)4 by Materials Project

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Abstract

PrOs4Sb12 is Skutterudite-derived structured and crystallizes in the cubic Im-3 space group. The structure is three-dimensional and consists of two praseodymium molecules and one OsSb3 framework. In the OsSb3 framework, Os+0.75- is bonded to six equivalent Sb atoms to form corner-sharing OsSb6 octahedra. The corner-sharing octahedral tilt angles are 55°. All Os–Sb bond lengths are 2.65 Å. Sb is bonded in a 2-coordinate geometry to two equivalent Os+0.75- and two equivalent Sb atoms. There are one shorter (2.96 Å) and one longer (3.02 Å) Sb–Sb bond lengths.

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-4251

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; Os-Pr-Sb; Pr(Sb3Os)4; crystal structure

OSTI Identifier:: 1208003

DOI:: https://doi.org/10.17188/1208003

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                    Materials Data on Pr(Sb3Os)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1208003.

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                    Materials Data on Pr(Sb3Os)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1208003

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                    2020.  
"Materials Data on Pr(Sb3Os)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1208003.  https://www.osti.gov/servlets/purl/1208003. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1208003,

  title        = {Materials Data on Pr(Sb3Os)4 by Materials Project},

  
  abstractNote = {PrOs4Sb12 is Skutterudite-derived structured and crystallizes in the cubic Im-3 space group. The structure is three-dimensional and consists of two praseodymium molecules and one OsSb3 framework. In the OsSb3 framework, Os+0.75- is bonded to six equivalent Sb atoms to form corner-sharing OsSb6 octahedra. The corner-sharing octahedral tilt angles are 55°. All Os–Sb bond lengths are 2.65 Å. Sb is bonded in a 2-coordinate geometry to two equivalent Os+0.75- and two equivalent Sb atoms. There are one shorter (2.96 Å) and one longer (3.02 Å) Sb–Sb bond lengths.},

  doi          = {10.17188/1208003},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1208003

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