Materials Data on PbBrCl by Materials Project

doi:10.17188/1317011

Title: Materials Data on PbBrCl by Materials Project

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Abstract

PbClBr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pb2+ is bonded in a 9-coordinate geometry to five equivalent Br1- and four equivalent Cl1- atoms. There are one shorter (3.18 Å) and four longer (3.48 Å) Pb–Br bond lengths. All Pb–Cl bond lengths are 2.99 Å. Br1- is bonded in a 1-coordinate geometry to five equivalent Pb2+ atoms. Cl1- is bonded to four equivalent Pb2+ atoms to form a mixture of edge and corner-sharing ClPb4 tetrahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-995147

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; PbBrCl; Br-Cl-Pb

OSTI Identifier:: 1317011

DOI:: https://doi.org/10.17188/1317011

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                    The Materials Project. Materials Data on PbBrCl by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1317011.

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                    The Materials Project. Materials Data on PbBrCl by Materials Project.  United States.  doi:https://doi.org/10.17188/1317011

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                    The Materials Project. 2020.  
"Materials Data on PbBrCl by Materials Project".  United States.  doi:https://doi.org/10.17188/1317011.  https://www.osti.gov/servlets/purl/1317011. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1317011,

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

  author       = {The Materials Project},

  abstractNote = {PbClBr is Matlockite structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pb2+ is bonded in a 9-coordinate geometry to five equivalent Br1- and four equivalent Cl1- atoms. There are one shorter (3.18 Å) and four longer (3.48 Å) Pb–Br bond lengths. All Pb–Cl bond lengths are 2.99 Å. Br1- is bonded in a 1-coordinate geometry to five equivalent Pb2+ atoms. Cl1- is bonded to four equivalent Pb2+ atoms to form a mixture of edge and corner-sharing ClPb4 tetrahedra.},

  doi          = {10.17188/1317011},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1317011

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