Materials Data on RbCoBr3 by Materials Project

doi:10.17188/1722032

Title: Materials Data on RbCoBr3 by Materials Project

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Abstract

RbCoBr3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent Br1- atoms to form RbBr12 cuboctahedra that share corners with six equivalent RbBr12 cuboctahedra, corners with six equivalent CoBr6 octahedra, faces with eight equivalent RbBr12 cuboctahedra, and faces with six equivalent CoBr6 octahedra. The corner-sharing octahedral tilt angles are 17°. There are six shorter (3.75 Å) and six longer (3.84 Å) Rb–Br bond lengths. Co2+ is bonded to six equivalent Br1- atoms to form CoBr6 octahedra that share corners with six equivalent RbBr12 cuboctahedra, faces with six equivalent RbBr12 cuboctahedra, and faces with two equivalent CoBr6 octahedra. All Co–Br bond lengths are 2.59 Å. Br1- is bonded in a 6-coordinate geometry to four equivalent Rb1+ and two equivalent Co2+ atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1206319

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; RbCoBr3; Br-Co-Rb

OSTI Identifier:: 1722032

DOI:: https://doi.org/10.17188/1722032

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                    The Materials Project. Materials Data on RbCoBr3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722032.

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                    The Materials Project. Materials Data on RbCoBr3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1722032

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                    The Materials Project. 2020.  
"Materials Data on RbCoBr3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1722032.  https://www.osti.gov/servlets/purl/1722032. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1722032,

  title        = {Materials Data on RbCoBr3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RbCoBr3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Rb1+ is bonded to twelve equivalent Br1- atoms to form RbBr12 cuboctahedra that share corners with six equivalent RbBr12 cuboctahedra, corners with six equivalent CoBr6 octahedra, faces with eight equivalent RbBr12 cuboctahedra, and faces with six equivalent CoBr6 octahedra. The corner-sharing octahedral tilt angles are 17°. There are six shorter (3.75 Å) and six longer (3.84 Å) Rb–Br bond lengths. Co2+ is bonded to six equivalent Br1- atoms to form CoBr6 octahedra that share corners with six equivalent RbBr12 cuboctahedra, faces with six equivalent RbBr12 cuboctahedra, and faces with two equivalent CoBr6 octahedra. All Co–Br bond lengths are 2.59 Å. Br1- is bonded in a 6-coordinate geometry to four equivalent Rb1+ and two equivalent Co2+ atoms.},

  doi          = {10.17188/1722032},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1722032

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