Materials Data on SrBiBrO2 by Materials Project

doi:10.17188/1267565

Title: Materials Data on SrBiBrO2 by Materials Project

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Abstract

SrBiO2Br crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sr2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Sr–O bond lengths are 2.50 Å. There are two shorter (3.44 Å) and two longer (3.56 Å) Sr–Br bond lengths. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. All Bi–O bond lengths are 2.23 Å. O2- is bonded to two equivalent Sr2+ and two equivalent Bi3+ atoms to form OSr2Bi2 tetrahedra that share corners with four equivalent OSr2Bi2 tetrahedra, corners with eight equivalent BrSr4 tetrahedra, and edges with four equivalent OSr2Bi2 tetrahedra. Br1- is bonded to four equivalent Sr2+ atoms to form distorted BrSr4 tetrahedra that share corners with four equivalent BrSr4 tetrahedra, corners with sixteen equivalent OSr2Bi2 tetrahedra, and edges with four equivalent BrSr4 tetrahedra.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-552234

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; SrBiBrO2; Bi-Br-O-Sr

OSTI Identifier:: 1267565

DOI:: https://doi.org/10.17188/1267565

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                    The Materials Project. Materials Data on SrBiBrO2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1267565.

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                    The Materials Project. Materials Data on SrBiBrO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1267565

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                    The Materials Project. 2020.  
"Materials Data on SrBiBrO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1267565.  https://www.osti.gov/servlets/purl/1267565. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1267565,

  title        = {Materials Data on SrBiBrO2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SrBiO2Br crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sr2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Sr–O bond lengths are 2.50 Å. There are two shorter (3.44 Å) and two longer (3.56 Å) Sr–Br bond lengths. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- atoms. All Bi–O bond lengths are 2.23 Å. O2- is bonded to two equivalent Sr2+ and two equivalent Bi3+ atoms to form OSr2Bi2 tetrahedra that share corners with four equivalent OSr2Bi2 tetrahedra, corners with eight equivalent BrSr4 tetrahedra, and edges with four equivalent OSr2Bi2 tetrahedra. Br1- is bonded to four equivalent Sr2+ atoms to form distorted BrSr4 tetrahedra that share corners with four equivalent BrSr4 tetrahedra, corners with sixteen equivalent OSr2Bi2 tetrahedra, and edges with four equivalent BrSr4 tetrahedra.},

  doi          = {10.17188/1267565},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1267565

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