Materials Data on ReBiO3 by Materials Project

doi:10.17188/1314565

Title: Materials Data on ReBiO3 by Materials Project

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Abstract

ReBiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Re3+ is bonded to six equivalent O2- atoms to form ReO6 octahedra that share corners with six equivalent ReO6 octahedra and faces with eight equivalent BiO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Re–O bond lengths are 2.01 Å. Bi3+ is bonded to twelve equivalent O2- atoms to form BiO12 cuboctahedra that share corners with twelve equivalent BiO12 cuboctahedra, faces with six equivalent BiO12 cuboctahedra, and faces with eight equivalent ReO6 octahedra. All Bi–O bond lengths are 2.85 Å. O2- is bonded in a distorted linear geometry to two equivalent Re3+ and four equivalent Bi3+ atoms.

Authors:: The Materials Project

Publication Date:: Sat Jul 18 00:00:00 EDT 2020

Other Number(s):: mp-974581

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; ReBiO3; Bi-O-Re

OSTI Identifier:: 1314565

DOI:: https://doi.org/10.17188/1314565

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                    The Materials Project. Materials Data on ReBiO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314565.

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                    The Materials Project. Materials Data on ReBiO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1314565

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                    The Materials Project. 2020.  
"Materials Data on ReBiO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1314565.  https://www.osti.gov/servlets/purl/1314565. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1314565,

  title        = {Materials Data on ReBiO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {ReBiO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Re3+ is bonded to six equivalent O2- atoms to form ReO6 octahedra that share corners with six equivalent ReO6 octahedra and faces with eight equivalent BiO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Re–O bond lengths are 2.01 Å. Bi3+ is bonded to twelve equivalent O2- atoms to form BiO12 cuboctahedra that share corners with twelve equivalent BiO12 cuboctahedra, faces with six equivalent BiO12 cuboctahedra, and faces with eight equivalent ReO6 octahedra. All Bi–O bond lengths are 2.85 Å. O2- is bonded in a distorted linear geometry to two equivalent Re3+ and four equivalent Bi3+ atoms.},

  doi          = {10.17188/1314565},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat Jul 18 00:00:00 EDT 2020},

  month        = {Sat Jul 18 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1314565

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