Materials Data on CsK3 by Materials Project

doi:10.17188/1688853

Title: Materials Data on CsK3 by Materials Project

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Abstract

CsK3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Cs is bonded to twelve K atoms to form a mixture of edge, corner, and face-sharing CsK12 cuboctahedra. There are four shorter (4.78 Å) and eight longer (4.96 Å) Cs–K bond lengths. There are two inequivalent K sites. In the first K site, K is bonded in a 8-coordinate geometry to four equivalent Cs and four equivalent K atoms. All K–K bond lengths are 4.78 Å. In the second K site, K is bonded in a square co-planar geometry to four equivalent Cs atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1183958

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; CsK3; Cs-K

OSTI Identifier:: 1688853

DOI:: https://doi.org/10.17188/1688853

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                    The Materials Project. Materials Data on CsK3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1688853.

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                    The Materials Project. Materials Data on CsK3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1688853

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                    The Materials Project. 2020.  
"Materials Data on CsK3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1688853.  https://www.osti.gov/servlets/purl/1688853. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1688853,

  title        = {Materials Data on CsK3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CsK3 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Cs is bonded to twelve K atoms to form a mixture of edge, corner, and face-sharing CsK12 cuboctahedra. There are four shorter (4.78 Å) and eight longer (4.96 Å) Cs–K bond lengths. There are two inequivalent K sites. In the first K site, K is bonded in a 8-coordinate geometry to four equivalent Cs and four equivalent K atoms. All K–K bond lengths are 4.78 Å. In the second K site, K is bonded in a square co-planar geometry to four equivalent Cs atoms.},

  doi          = {10.17188/1688853},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1688853

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