Materials Data on Na3Ru by Materials Project

doi:10.17188/1747243

Title: Materials Data on Na3Ru by Materials Project

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Abstract

Na3Ru is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded to four equivalent Ru atoms to form a mixture of distorted edge and corner-sharing NaRu4 cuboctahedra. All Na–Ru bond lengths are 3.20 Å. In the second Na site, Na is bonded in a distorted square co-planar geometry to four equivalent Ru atoms. All Na–Ru bond lengths are 3.17 Å. Ru is bonded to twelve Na atoms to form a mixture of edge, corner, and face-sharing RuNa12 cuboctahedra.

Publication Date:: 2020-05-05

Other Number(s):: mp-1186076

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; Na-Ru; Na3Ru; crystal structure

OSTI Identifier:: 1747243

DOI:: https://doi.org/10.17188/1747243

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                    Materials Data on Na3Ru by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1747243.

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                    Materials Data on Na3Ru by Materials Project.  United States.  doi:https://doi.org/10.17188/1747243

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                    2020.  
"Materials Data on Na3Ru by Materials Project".  United States.  doi:https://doi.org/10.17188/1747243.  https://www.osti.gov/servlets/purl/1747243. Pub date:Tue May 05 00:00:00 EDT 2020

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@article{osti_1747243,

  title        = {Materials Data on Na3Ru by Materials Project},

  
  abstractNote = {Na3Ru is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Na sites. In the first Na site, Na is bonded to four equivalent Ru atoms to form a mixture of distorted edge and corner-sharing NaRu4 cuboctahedra. All Na–Ru bond lengths are 3.20 Å. In the second Na site, Na is bonded in a distorted square co-planar geometry to four equivalent Ru atoms. All Na–Ru bond lengths are 3.17 Å. Ru is bonded to twelve Na atoms to form a mixture of edge, corner, and face-sharing RuNa12 cuboctahedra.},

  doi          = {10.17188/1747243},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1747243

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