Materials Data on K3Sb by Materials Project

doi:10.17188/1186692

Title: Materials Data on K3Sb by Materials Project

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Abstract

K3Sb is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a body-centered cubic geometry to eight equivalent K1+ atoms. All K–K bond lengths are 3.71 Å. In the second K1+ site, K1+ is bonded to four equivalent K1+ and four equivalent Sb3- atoms to form a mixture of corner, edge, and face-sharing KK4Sb4 tetrahedra. All K–Sb bond lengths are 3.71 Å. Sb3- is bonded in a body-centered cubic geometry to eight equivalent K1+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-10159

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; K3Sb; K-Sb

OSTI Identifier:: 1186692

DOI:: https://doi.org/10.17188/1186692

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                    The Materials Project. Materials Data on K3Sb by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1186692.

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                    The Materials Project. Materials Data on K3Sb by Materials Project.  United States.  doi:https://doi.org/10.17188/1186692

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                    The Materials Project. 2020.  
"Materials Data on K3Sb by Materials Project".  United States.  doi:https://doi.org/10.17188/1186692.  https://www.osti.gov/servlets/purl/1186692. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1186692,

  title        = {Materials Data on K3Sb by Materials Project},

  author       = {The Materials Project},

  abstractNote = {K3Sb is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a body-centered cubic geometry to eight equivalent K1+ atoms. All K–K bond lengths are 3.71 Å. In the second K1+ site, K1+ is bonded to four equivalent K1+ and four equivalent Sb3- atoms to form a mixture of corner, edge, and face-sharing KK4Sb4 tetrahedra. All K–Sb bond lengths are 3.71 Å. Sb3- is bonded in a body-centered cubic geometry to eight equivalent K1+ atoms.},

  doi          = {10.17188/1186692},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1186692

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