Materials Data on ZnCrF6 by Materials Project

doi:10.17188/1206980

Title: Materials Data on ZnCrF6 by Materials Project

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Abstract

CrZnF6 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Cr4+ is bonded to six equivalent F1- atoms to form CrF6 octahedra that share corners with six equivalent ZnF6 octahedra. The corner-sharing octahedral tilt angles are 33°. All Cr–F bond lengths are 1.86 Å. Zn2+ is bonded to six equivalent F1- atoms to form ZnF6 octahedra that share corners with six equivalent CrF6 octahedra. The corner-sharing octahedral tilt angles are 33°. All Zn–F bond lengths are 2.05 Å. F1- is bonded in a bent 150 degrees geometry to one Cr4+ and one Zn2+ atom.

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-35311

DOE Contract Number:: AC02-05CH11231; EDCBEE

Research Org.:: Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Collaborations:: MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE

Keywords:: crystal structure; ZnCrF6; Cr-F-Zn

OSTI Identifier:: 1206980

DOI:: https://doi.org/10.17188/1206980

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                    The Materials Project. Materials Data on ZnCrF6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1206980.

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                    The Materials Project. Materials Data on ZnCrF6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1206980

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                    The Materials Project. 2020.  
"Materials Data on ZnCrF6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1206980.  https://www.osti.gov/servlets/purl/1206980. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1206980,

  title        = {Materials Data on ZnCrF6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CrZnF6 crystallizes in the trigonal R-3 space group. The structure is three-dimensional. Cr4+ is bonded to six equivalent F1- atoms to form CrF6 octahedra that share corners with six equivalent ZnF6 octahedra. The corner-sharing octahedral tilt angles are 33°. All Cr–F bond lengths are 1.86 Å. Zn2+ is bonded to six equivalent F1- atoms to form ZnF6 octahedra that share corners with six equivalent CrF6 octahedra. The corner-sharing octahedral tilt angles are 33°. All Zn–F bond lengths are 2.05 Å. F1- is bonded in a bent 150 degrees geometry to one Cr4+ and one Zn2+ atom.},

  doi          = {10.17188/1206980},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1206980

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