Materials Data on Al2PbO4 by Materials Project

doi:10.17188/1197231

Title: Materials Data on Al2PbO4 by Materials Project

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Abstract

PbAl2O4 crystallizes in the orthorhombic Ama2 space group. The structure is three-dimensional. Al3+ is bonded to four O2- atoms to form corner-sharing AlO4 tetrahedra. There are a spread of Al–O bond distances ranging from 1.76–1.79 Å. Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.33–2.84 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Al3+ and one Pb2+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Al3+ and two equivalent Pb2+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one Pb2+ atom.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-21892

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; Al2PbO4; Al-O-Pb

OSTI Identifier:: 1197231

DOI:: https://doi.org/10.17188/1197231

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                    The Materials Project. Materials Data on Al2PbO4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1197231.

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                    The Materials Project. Materials Data on Al2PbO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1197231

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                    The Materials Project. 2020.  
"Materials Data on Al2PbO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1197231.  https://www.osti.gov/servlets/purl/1197231. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1197231,

  title        = {Materials Data on Al2PbO4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PbAl2O4 crystallizes in the orthorhombic Ama2 space group. The structure is three-dimensional. Al3+ is bonded to four O2- atoms to form corner-sharing AlO4 tetrahedra. There are a spread of Al–O bond distances ranging from 1.76–1.79 Å. Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.33–2.84 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Al3+ and one Pb2+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Al3+ and two equivalent Pb2+ atoms. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent Al3+ and one Pb2+ atom.},

  doi          = {10.17188/1197231},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1197231

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