Materials Data on KPd2O3 by Materials Project

doi:10.17188/1698927

Title: Materials Data on KPd2O3 by Materials Project

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Abstract

KPd2O3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. K is bonded in a 6-coordinate geometry to six equivalent O atoms. There are three shorter (2.70 Å) and three longer (2.82 Å) K–O bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in an octahedral geometry to six equivalent O atoms. All Pd–O bond lengths are 2.07 Å. In the second Pd site, Pd is bonded in a square co-planar geometry to four equivalent O atoms. All Pd–O bond lengths are 2.06 Å. O is bonded to two equivalent K and three Pd atoms to form a mixture of distorted edge and corner-sharing OK2Pd3 trigonal bipyramids.

Authors:: The Materials Project

Publication Date:: 2020-05-09

Other Number(s):: mp-1095520

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; KPd2O3; K-O-Pd

OSTI Identifier:: 1698927

DOI:: https://doi.org/10.17188/1698927

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                    The Materials Project. Materials Data on KPd2O3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1698927.

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                    The Materials Project. Materials Data on KPd2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1698927

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                    The Materials Project. 2020.  
"Materials Data on KPd2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1698927.  https://www.osti.gov/servlets/purl/1698927. Pub date:Sat May 09 00:00:00 EDT 2020

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@article{osti_1698927,

  title        = {Materials Data on KPd2O3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {KPd2O3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. K is bonded in a 6-coordinate geometry to six equivalent O atoms. There are three shorter (2.70 Å) and three longer (2.82 Å) K–O bond lengths. There are two inequivalent Pd sites. In the first Pd site, Pd is bonded in an octahedral geometry to six equivalent O atoms. All Pd–O bond lengths are 2.07 Å. In the second Pd site, Pd is bonded in a square co-planar geometry to four equivalent O atoms. All Pd–O bond lengths are 2.06 Å. O is bonded to two equivalent K and three Pd atoms to form a mixture of distorted edge and corner-sharing OK2Pd3 trigonal bipyramids.},

  doi          = {10.17188/1698927},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1698927

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