Materials Data on NaB(CN)4 by Materials Project

doi:10.17188/1276255

Title: Materials Data on NaB(CN)4 by Materials Project

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Abstract

Na(CN)4B is Zintl Phase structured and crystallizes in the cubic Fd-3m space group. The structure is zero-dimensional and consists of eight boron molecules and eight Na(CN)4 clusters. In each Na(CN)4 cluster, Na1+ is bonded in a tetrahedral geometry to four equivalent N3- atoms. All Na–N bond lengths are 2.39 Å. C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.16 Å. N3- is bonded in a linear geometry to one Na1+ and one C2+ atom.

Publication Date:: Sat May 02 04:00:00 UTC 2020

Other Number(s):: mp-571433

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; B-C-N-Na; NaB(CN)4; crystal structure

OSTI Identifier:: 1276255

DOI:: https://doi.org/10.17188/1276255

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                    Materials Data on NaB(CN)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276255.

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                    Materials Data on NaB(CN)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1276255

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                    2020.  
"Materials Data on NaB(CN)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1276255.  https://www.osti.gov/servlets/purl/1276255. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1276255,

  title        = {Materials Data on NaB(CN)4 by Materials Project},

  
  abstractNote = {Na(CN)4B is Zintl Phase structured and crystallizes in the cubic Fd-3m space group. The structure is zero-dimensional and consists of eight boron molecules and eight Na(CN)4 clusters. In each Na(CN)4 cluster, Na1+ is bonded in a tetrahedral geometry to four equivalent N3- atoms. All Na–N bond lengths are 2.39 Å. C2+ is bonded in a single-bond geometry to one N3- atom. The C–N bond length is 1.16 Å. N3- is bonded in a linear geometry to one Na1+ and one C2+ atom.},

  doi          = {10.17188/1276255},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 04:00:00 UTC 2020},

  month        = {Sat May 02 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1276255

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