Materials Data on Bi4(BO4)3 by Materials Project

doi:10.17188/1298631

Title: Materials Data on Bi4(BO4)3 by Materials Project

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Abstract

Bi4(BO4)3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. B3+ is bonded to four equivalent O2- atoms to form BO4 tetrahedra that share corners with eight equivalent BiO6 pentagonal pyramids. All B–O bond lengths are 1.48 Å. Bi+3.75+ is bonded to six equivalent O2- atoms to form distorted BiO6 pentagonal pyramids that share corners with six equivalent BO4 tetrahedra and edges with three equivalent BiO6 pentagonal pyramids. There are three shorter (2.24 Å) and three longer (2.42 Å) Bi–O bond lengths. O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.75+ atoms.

Publication Date:: Sat May 02 04:00:00 UTC 2020

Other Number(s):: mp-769052

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; B-Bi-O; Bi4(BO4)3; crystal structure

OSTI Identifier:: 1298631

DOI:: https://doi.org/10.17188/1298631

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                    Materials Data on Bi4(BO4)3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1298631.

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                    Materials Data on Bi4(BO4)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1298631

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                    2020.  
"Materials Data on Bi4(BO4)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1298631.  https://www.osti.gov/servlets/purl/1298631. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1298631,

  title        = {Materials Data on Bi4(BO4)3 by Materials Project},

  
  abstractNote = {Bi4(BO4)3 crystallizes in the cubic I-43d space group. The structure is three-dimensional. B3+ is bonded to four equivalent O2- atoms to form BO4 tetrahedra that share corners with eight equivalent BiO6 pentagonal pyramids. All B–O bond lengths are 1.48 Å. Bi+3.75+ is bonded to six equivalent O2- atoms to form distorted BiO6 pentagonal pyramids that share corners with six equivalent BO4 tetrahedra and edges with three equivalent BiO6 pentagonal pyramids. There are three shorter (2.24 Å) and three longer (2.42 Å) Bi–O bond lengths. O2- is bonded in a distorted single-bond geometry to one B3+ and two equivalent Bi+3.75+ atoms.},

  doi          = {10.17188/1298631},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 04:00:00 UTC 2020},

  month        = {Sat May 02 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1298631

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