Materials Data on NaPPdS4 by Materials Project

doi:10.17188/1270866

Title: Materials Data on NaPPdS4 by Materials Project

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Abstract

NaPdPS4 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Na1+ is bonded in a 8-coordinate geometry to eight equivalent S2- atoms. All Na–S bond lengths are 3.15 Å. Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.36 Å. P5+ is bonded in a tetrahedral geometry to four equivalent S2- atoms. All P–S bond lengths are 2.06 Å. S2- is bonded to two equivalent Na1+, one Pd2+, and one P5+ atom to form a mixture of distorted edge and corner-sharing SNa2PPd trigonal pyramids.

Authors:: The Materials Project

Publication Date:: 2020-07-17

Other Number(s):: mp-559446

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; NaPPdS4; Na-P-Pd-S

OSTI Identifier:: 1270866

DOI:: https://doi.org/10.17188/1270866

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                    The Materials Project. Materials Data on NaPPdS4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1270866.

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                    The Materials Project. Materials Data on NaPPdS4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1270866

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                    The Materials Project. 2020.  
"Materials Data on NaPPdS4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1270866.  https://www.osti.gov/servlets/purl/1270866. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1270866,

  title        = {Materials Data on NaPPdS4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NaPdPS4 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. Na1+ is bonded in a 8-coordinate geometry to eight equivalent S2- atoms. All Na–S bond lengths are 3.15 Å. Pd2+ is bonded in a square co-planar geometry to four equivalent S2- atoms. All Pd–S bond lengths are 2.36 Å. P5+ is bonded in a tetrahedral geometry to four equivalent S2- atoms. All P–S bond lengths are 2.06 Å. S2- is bonded to two equivalent Na1+, one Pd2+, and one P5+ atom to form a mixture of distorted edge and corner-sharing SNa2PPd trigonal pyramids.},

  doi          = {10.17188/1270866},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1270866

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