Materials Data on KNaS by Materials Project

doi:10.17188/1202505

Title: Materials Data on KNaS by Materials Project

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Abstract

KNaS crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. K1+ is bonded in a 5-coordinate geometry to five equivalent S2- atoms. There are one shorter (3.21 Å) and four longer (3.35 Å) K–S bond lengths. Na1+ is bonded to four equivalent S2- atoms to form a mixture of edge and corner-sharing NaS4 tetrahedra. There are a spread of Na–S bond distances ranging from 2.84–2.90 Å. S2- is bonded in a 9-coordinate geometry to five equivalent K1+ and four equivalent Na1+ atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-28383

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; KNaS; K-Na-S

OSTI Identifier:: 1202505

DOI:: https://doi.org/10.17188/1202505

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                    The Materials Project. Materials Data on KNaS by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1202505.

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                    The Materials Project. Materials Data on KNaS by Materials Project.  United States.  doi:https://doi.org/10.17188/1202505

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                    The Materials Project. 2020.  
"Materials Data on KNaS by Materials Project".  United States.  doi:https://doi.org/10.17188/1202505.  https://www.osti.gov/servlets/purl/1202505. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1202505,

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

  author       = {The Materials Project},

  abstractNote = {KNaS crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. K1+ is bonded in a 5-coordinate geometry to five equivalent S2- atoms. There are one shorter (3.21 Å) and four longer (3.35 Å) K–S bond lengths. Na1+ is bonded to four equivalent S2- atoms to form a mixture of edge and corner-sharing NaS4 tetrahedra. There are a spread of Na–S bond distances ranging from 2.84–2.90 Å. S2- is bonded in a 9-coordinate geometry to five equivalent K1+ and four equivalent Na1+ atoms.},

  doi          = {10.17188/1202505},

  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/10.17188/1202505

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