Materials Data on CsReF8 by Materials Project

doi:10.17188/1204290

Title: Materials Data on CsReF8 by Materials Project

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Abstract

CsReF8 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Cs1+ is bonded to twelve F1- atoms to form distorted edge-sharing CsF12 cuboctahedra. There are four shorter (3.24 Å) and eight longer (3.25 Å) Cs–F bond lengths. Re7+ is bonded in a 8-coordinate geometry to eight F1- atoms. There is four shorter (1.92 Å) and four longer (1.94 Å) Re–F bond length. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to two equivalent Cs1+ and one Re7+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to one Cs1+ and one Re7+ atom.

Authors:: The Materials Project

Publication Date:: Tue Jul 14 00:00:00 EDT 2020

Other Number(s):: mp-29842

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; CsReF8; Cs-F-Re

OSTI Identifier:: 1204290

DOI:: https://doi.org/10.17188/1204290

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                    The Materials Project. Materials Data on CsReF8 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1204290.

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                    The Materials Project. Materials Data on CsReF8 by Materials Project.  United States.  doi:https://doi.org/10.17188/1204290

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                    The Materials Project. 2020.  
"Materials Data on CsReF8 by Materials Project".  United States.  doi:https://doi.org/10.17188/1204290.  https://www.osti.gov/servlets/purl/1204290. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1204290,

  title        = {Materials Data on CsReF8 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CsReF8 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Cs1+ is bonded to twelve F1- atoms to form distorted edge-sharing CsF12 cuboctahedra. There are four shorter (3.24 Å) and eight longer (3.25 Å) Cs–F bond lengths. Re7+ is bonded in a 8-coordinate geometry to eight F1- atoms. There is four shorter (1.92 Å) and four longer (1.94 Å) Re–F bond length. There are two inequivalent F1- sites. In the first F1- site, F1- is bonded in a single-bond geometry to two equivalent Cs1+ and one Re7+ atom. In the second F1- site, F1- is bonded in a distorted single-bond geometry to one Cs1+ and one Re7+ atom.},

  doi          = {10.17188/1204290},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jul 14 00:00:00 EDT 2020},

  month        = {Tue Jul 14 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1204290

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