Materials Data on BiPbBrO2 by Materials Project

doi:10.17188/1729410

Title: Materials Data on BiPbBrO2 by Materials Project

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Abstract

PbBiO2Br crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Pb2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Pb–O bond lengths are 2.43 Å. All Pb–Br bond lengths are 3.52 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Bi–O bond lengths are 2.29 Å. All Bi–Br bond lengths are 3.49 Å. O2- is bonded to two equivalent Pb2+ and two equivalent Bi3+ atoms to form a mixture of edge and corner-sharing OBi2Pb2 tetrahedra. Br1- is bonded in a body-centered cubic geometry to four equivalent Pb2+ and four equivalent Bi3+ atoms.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-1227444

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; BiPbBrO2; Bi-Br-O-Pb

OSTI Identifier:: 1729410

DOI:: https://doi.org/10.17188/1729410

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                    The Materials Project. Materials Data on BiPbBrO2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1729410.

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                    The Materials Project. Materials Data on BiPbBrO2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1729410

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                    The Materials Project. 2020.  
"Materials Data on BiPbBrO2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1729410.  https://www.osti.gov/servlets/purl/1729410. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1729410,

  title        = {Materials Data on BiPbBrO2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PbBiO2Br crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Pb2+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Pb–O bond lengths are 2.43 Å. All Pb–Br bond lengths are 3.52 Å. Bi3+ is bonded in a 4-coordinate geometry to four equivalent O2- and four equivalent Br1- atoms. All Bi–O bond lengths are 2.29 Å. All Bi–Br bond lengths are 3.49 Å. O2- is bonded to two equivalent Pb2+ and two equivalent Bi3+ atoms to form a mixture of edge and corner-sharing OBi2Pb2 tetrahedra. Br1- is bonded in a body-centered cubic geometry to four equivalent Pb2+ and four equivalent Bi3+ atoms.},

  doi          = {10.17188/1729410},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1729410

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