Materials Data on As2Pb2O5 by Materials Project

doi:10.17188/1262546

Title: Materials Data on As2Pb2O5 by Materials Project

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Abstract

Pb2As2O5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.36–2.99 Å. In the second Pb2+ site, Pb2+ is bonded in a 4-coordinate geometry to six O2- atoms. There are a spread of Pb–O bond distances ranging from 2.32–3.18 Å. There are two inequivalent As3+ sites. In the first As3+ site, As3+ is bonded in a distorted trigonal non-coplanar geometry to three O2- atoms. There are a spread of As–O bond distances ranging from 1.78–1.87 Å. In the second As3+ site, As3+ is bonded in a distorted trigonal non-coplanar geometry to three O2- atoms. There are a spread of As–O bond distances ranging from 1.77–1.88 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to two Pb2+ and one As3+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to three Pb2+ and one As3+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to three Pb2+ andmore »« less

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-505465

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; As2Pb2O5; As-O-Pb

OSTI Identifier:: 1262546

DOI:: https://doi.org/10.17188/1262546

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                    The Materials Project. Materials Data on As2Pb2O5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1262546.

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                    The Materials Project. Materials Data on As2Pb2O5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1262546

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                    The Materials Project. 2020.  
"Materials Data on As2Pb2O5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1262546.  https://www.osti.gov/servlets/purl/1262546. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1262546,

  title        = {Materials Data on As2Pb2O5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Pb2As2O5 crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. there are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.36–2.99 Å. In the second Pb2+ site, Pb2+ is bonded in a 4-coordinate geometry to six O2- atoms. There are a spread of Pb–O bond distances ranging from 2.32–3.18 Å. There are two inequivalent As3+ sites. In the first As3+ site, As3+ is bonded in a distorted trigonal non-coplanar geometry to three O2- atoms. There are a spread of As–O bond distances ranging from 1.78–1.87 Å. In the second As3+ site, As3+ is bonded in a distorted trigonal non-coplanar geometry to three O2- atoms. There are a spread of As–O bond distances ranging from 1.77–1.88 Å. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a 1-coordinate geometry to two Pb2+ and one As3+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to three Pb2+ and one As3+ atom. In the third O2- site, O2- is bonded in a 1-coordinate geometry to three Pb2+ and one As3+ atom. In the fourth O2- site, O2- is bonded in a distorted bent 120 degrees geometry to one Pb2+ and two As3+ atoms. In the fifth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Pb2+ and one As3+ atom.},

  doi          = {10.17188/1262546},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1262546

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