Materials Data on Bi2O3 by Materials Project

doi:10.17188/1199315

Title: Materials Data on Bi2O3 by Materials Project

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Abstract

Bi2O3 is Antimony trioxide-like structured and crystallizes in the tetragonal P-42_1c space group. The structure is three-dimensional. Bi3+ is bonded to five O2- atoms to form a mixture of distorted corner and edge-sharing BiO5 square pyramids. There are a spread of Bi–O bond distances ranging from 2.16–2.67 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four equivalent Bi3+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to three equivalent Bi3+ atoms.

Publication Date:: 2020-05-03

Other Number(s):: mp-23195

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; Bi-O; Bi2O3; crystal structure

OSTI Identifier:: 1199315

DOI:: https://doi.org/10.17188/1199315

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                    Materials Data on Bi2O3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199315.

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                    Materials Data on Bi2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1199315

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                    2020.  
"Materials Data on Bi2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1199315.  https://www.osti.gov/servlets/purl/1199315. Pub date:Sun May 03 04:00:00 UTC 2020

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@article{osti_1199315,

  title        = {Materials Data on Bi2O3 by Materials Project},

  
  abstractNote = {Bi2O3 is Antimony trioxide-like structured and crystallizes in the tetragonal P-42_1c space group. The structure is three-dimensional. Bi3+ is bonded to five O2- atoms to form a mixture of distorted corner and edge-sharing BiO5 square pyramids. There are a spread of Bi–O bond distances ranging from 2.16–2.67 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to four equivalent Bi3+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to three equivalent Bi3+ atoms.},

  doi          = {10.17188/1199315},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1199315

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