Materials Data on K2CrF6 by Materials Project

doi:10.17188/1677230

Title: Materials Data on K2CrF6 by Materials Project

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Abstract

K2CrF6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K1+ is bonded to twelve equivalent F1- atoms to form KF12 cuboctahedra that share corners with twelve equivalent KF12 cuboctahedra, faces with six equivalent KF12 cuboctahedra, and faces with four equivalent CrF6 octahedra. All K–F bond lengths are 2.95 Å. Cr4+ is bonded to six equivalent F1- atoms to form CrF6 octahedra that share faces with eight equivalent KF12 cuboctahedra. All Cr–F bond lengths are 1.87 Å. F1- is bonded in a single-bond geometry to four equivalent K1+ and one Cr4+ atom.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1211950

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; K2CrF6; Cr-F-K

OSTI Identifier:: 1677230

DOI:: https://doi.org/10.17188/1677230

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                    The Materials Project. Materials Data on K2CrF6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1677230.

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                    The Materials Project. Materials Data on K2CrF6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1677230

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                    The Materials Project. 2020.  
"Materials Data on K2CrF6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1677230.  https://www.osti.gov/servlets/purl/1677230. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1677230,

  title        = {Materials Data on K2CrF6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {K2CrF6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. K1+ is bonded to twelve equivalent F1- atoms to form KF12 cuboctahedra that share corners with twelve equivalent KF12 cuboctahedra, faces with six equivalent KF12 cuboctahedra, and faces with four equivalent CrF6 octahedra. All K–F bond lengths are 2.95 Å. Cr4+ is bonded to six equivalent F1- atoms to form CrF6 octahedra that share faces with eight equivalent KF12 cuboctahedra. All Cr–F bond lengths are 1.87 Å. F1- is bonded in a single-bond geometry to four equivalent K1+ and one Cr4+ atom.},

  doi          = {10.17188/1677230},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1677230

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