Materials Data on K2Pb(SO4)2 by Materials Project

doi:10.17188/1281300

Title: Materials Data on K2Pb(SO4)2 by Materials Project

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Abstract

K2Pb(SO4)2 is Copper structured and crystallizes in the trigonal R-3m space group. The structure is zero-dimensional and consists of three K2Pb(SO4)2 clusters. K1+ is bonded in a single-bond geometry to one O2- atom. The K–O bond length is 2.45 Å. Pb2+ is bonded in a hexagonal planar geometry to six equivalent O2- atoms. All Pb–O bond lengths are 2.53 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.45 Å) and three longer (1.53 Å) S–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Pb2+ and one S6+ atom. In the second O2- site, O2- is bonded in a linear geometry to one K1+ and one S6+ atom.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-655105

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; K2Pb(SO4)2; K-O-Pb-S

OSTI Identifier:: 1281300

DOI:: https://doi.org/10.17188/1281300

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                    The Materials Project. Materials Data on K2Pb(SO4)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1281300.

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                    The Materials Project. Materials Data on K2Pb(SO4)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1281300

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                    The Materials Project. 2020.  
"Materials Data on K2Pb(SO4)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1281300.  https://www.osti.gov/servlets/purl/1281300. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1281300,

  title        = {Materials Data on K2Pb(SO4)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {K2Pb(SO4)2 is Copper structured and crystallizes in the trigonal R-3m space group. The structure is zero-dimensional and consists of three K2Pb(SO4)2 clusters. K1+ is bonded in a single-bond geometry to one O2- atom. The K–O bond length is 2.45 Å. Pb2+ is bonded in a hexagonal planar geometry to six equivalent O2- atoms. All Pb–O bond lengths are 2.53 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is one shorter (1.45 Å) and three longer (1.53 Å) S–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Pb2+ and one S6+ atom. In the second O2- site, O2- is bonded in a linear geometry to one K1+ and one S6+ atom.},

  doi          = {10.17188/1281300},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1281300

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