Materials Data on SbP(Cl2F3)2 by Materials Project

doi:10.17188/1270793

Title: Materials Data on SbP(Cl2F3)2 by Materials Project

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Abstract

SbF6PCl4 is beta-prime cadmium gold structured and crystallizes in the tetragonal P4/n space group. The structure is zero-dimensional and consists of two [pcl4]+1 molecules and two SbF6 clusters. In each SbF6 cluster, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is five shorter (1.92 Å) and one longer (1.93 Å) Sb–F bond length. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.

Publication Date:: Thu Jul 23 04:00:00 UTC 2020

Other Number(s):: mp-559301

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; Cl-F-P-Sb; SbP(Cl2F3)2; crystal structure

OSTI Identifier:: 1270793

DOI:: https://doi.org/10.17188/1270793

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                    Materials Data on SbP(Cl2F3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1270793.

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                    Materials Data on SbP(Cl2F3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1270793

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                    2020.  
"Materials Data on SbP(Cl2F3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1270793.  https://www.osti.gov/servlets/purl/1270793. Pub date:Thu Jul 23 04:00:00 UTC 2020

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@article{osti_1270793,

  title        = {Materials Data on SbP(Cl2F3)2 by Materials Project},

  
  abstractNote = {SbF6PCl4 is beta-prime cadmium gold structured and crystallizes in the tetragonal P4/n space group. The structure is zero-dimensional and consists of two [pcl4]+1 molecules and two SbF6 clusters. In each SbF6 cluster, Sb5+ is bonded in an octahedral geometry to six F1- atoms. There is five shorter (1.92 Å) and one longer (1.93 Å) Sb–F bond length. There are three inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the second F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom. In the third F1- site, F1- is bonded in a single-bond geometry to one Sb5+ atom.},

  doi          = {10.17188/1270793},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 04:00:00 UTC 2020},

  month        = {Thu Jul 23 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1270793

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