Materials Data on Pb3O4 by Materials Project

doi:10.17188/1198840

Title: Materials Data on Pb3O4 by Materials Project

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Abstract

Pb3O4 crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. there are two inequivalent Pb+2.67+ sites. In the first Pb+2.67+ site, Pb+2.67+ is bonded to six O2- atoms to form edge-sharing PbO6 octahedra. There are two shorter (2.18 Å) and four longer (2.25 Å) Pb–O bond lengths. In the second Pb+2.67+ site, Pb+2.67+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.82 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four Pb+2.67+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to three Pb+2.67+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-17

Other Number(s):: mp-22633

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; Pb3O4; O-Pb

OSTI Identifier:: 1198840

DOI:: https://doi.org/10.17188/1198840

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                    The Materials Project. Materials Data on Pb3O4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1198840.

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                    The Materials Project. Materials Data on Pb3O4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1198840

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                    The Materials Project. 2020.  
"Materials Data on Pb3O4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1198840.  https://www.osti.gov/servlets/purl/1198840. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1198840,

  title        = {Materials Data on Pb3O4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Pb3O4 crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. there are two inequivalent Pb+2.67+ sites. In the first Pb+2.67+ site, Pb+2.67+ is bonded to six O2- atoms to form edge-sharing PbO6 octahedra. There are two shorter (2.18 Å) and four longer (2.25 Å) Pb–O bond lengths. In the second Pb+2.67+ site, Pb+2.67+ is bonded in a distorted rectangular see-saw-like geometry to four O2- atoms. There are a spread of Pb–O bond distances ranging from 2.25–2.82 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four Pb+2.67+ atoms. In the second O2- site, O2- is bonded in a trigonal planar geometry to three Pb+2.67+ atoms.},

  doi          = {10.17188/1198840},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1198840

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