Materials Data on Cs2PdBr6 by Materials Project

doi:10.17188/1689103

Title: Materials Data on Cs2PdBr6 by Materials Project

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Abstract

Cs2PdBr6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Br1- atoms to form CsBr12 cuboctahedra that share corners with twelve equivalent CsBr12 cuboctahedra, faces with six equivalent CsBr12 cuboctahedra, and faces with four equivalent PdBr6 octahedra. All Cs–Br bond lengths are 3.89 Å. Pd4+ is bonded to six equivalent Br1- atoms to form PdBr6 octahedra that share faces with eight equivalent CsBr12 cuboctahedra. All Pd–Br bond lengths are 2.52 Å. Br1- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Pd4+ atom.

Authors:: The Materials Project

Publication Date:: Sat May 09 00:00:00 EDT 2020

Other Number(s):: mp-1205847

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; Cs2PdBr6; Br-Cs-Pd

OSTI Identifier:: 1689103

DOI:: https://doi.org/10.17188/1689103

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                    The Materials Project. Materials Data on Cs2PdBr6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1689103.

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                    The Materials Project. Materials Data on Cs2PdBr6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1689103

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                    The Materials Project. 2020.  
"Materials Data on Cs2PdBr6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1689103.  https://www.osti.gov/servlets/purl/1689103. Pub date:Sat May 09 00:00:00 EDT 2020

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@article{osti_1689103,

  title        = {Materials Data on Cs2PdBr6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Cs2PdBr6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Br1- atoms to form CsBr12 cuboctahedra that share corners with twelve equivalent CsBr12 cuboctahedra, faces with six equivalent CsBr12 cuboctahedra, and faces with four equivalent PdBr6 octahedra. All Cs–Br bond lengths are 3.89 Å. Pd4+ is bonded to six equivalent Br1- atoms to form PdBr6 octahedra that share faces with eight equivalent CsBr12 cuboctahedra. All Pd–Br bond lengths are 2.52 Å. Br1- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Pd4+ atom.},

  doi          = {10.17188/1689103},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 09 00:00:00 EDT 2020},

  month        = {Sat May 09 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1689103

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