Materials Data on NaIn(NF3)2 by Materials Project

doi:10.17188/1736449

Title: Materials Data on NaIn(NF3)2 by Materials Project

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Abstract

NaInF6N2 is High-temperature superconductor-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight ammonia molecules and one NaInF6 framework. In the NaInF6 framework, Na1+ is bonded to six equivalent F1- atoms to form NaF6 octahedra that share corners with six equivalent InF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Na–F bond lengths are 2.25 Å. In3+ is bonded to six equivalent F1- atoms to form InF6 octahedra that share corners with six equivalent NaF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All In–F bond lengths are 2.10 Å. F1- is bonded in a linear geometry to one Na1+ and one In3+ atom.

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1205660

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; F-In-N-Na; NaIn(NF3)2; crystal structure

OSTI Identifier:: 1736449

DOI:: https://doi.org/10.17188/1736449

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                    Materials Data on NaIn(NF3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1736449.

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                    Materials Data on NaIn(NF3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1736449

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                    2020.  
"Materials Data on NaIn(NF3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1736449.  https://www.osti.gov/servlets/purl/1736449. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1736449,

  title        = {Materials Data on NaIn(NF3)2 by Materials Project},

  
  abstractNote = {NaInF6N2 is High-temperature superconductor-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of eight ammonia molecules and one NaInF6 framework. In the NaInF6 framework, Na1+ is bonded to six equivalent F1- atoms to form NaF6 octahedra that share corners with six equivalent InF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All Na–F bond lengths are 2.25 Å. In3+ is bonded to six equivalent F1- atoms to form InF6 octahedra that share corners with six equivalent NaF6 octahedra. The corner-sharing octahedral tilt angles are 0°. All In–F bond lengths are 2.10 Å. F1- is bonded in a linear geometry to one Na1+ and one In3+ atom.},

  doi          = {10.17188/1736449},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1736449

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