Materials Data on K2PtS6 by Materials Project

doi:10.17188/1696071

Title: Materials Data on K2PtS6 by Materials Project

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Abstract

K2PtS6 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to six S+0.67- atoms. There are a spread of K–S bond distances ranging from 3.22–3.44 Å. Pt2+ is bonded in a distorted hexagonal planar geometry to six S+0.67- atoms. All Pt–S bond lengths are 2.39 Å. There are two inequivalent S+0.67- sites. In the first S+0.67- site, S+0.67- is bonded in a 3-coordinate geometry to two equivalent K1+ and one Pt2+ atom. In the second S+0.67- site, S+0.67- is bonded in a 4-coordinate geometry to two equivalent K1+, one Pt2+, and one S+0.67- atom. The S–S bond length is 2.11 Å.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1079869

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; K2PtS6; K-Pt-S

OSTI Identifier:: 1696071

DOI:: https://doi.org/10.17188/1696071

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                    The Materials Project. Materials Data on K2PtS6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1696071.

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                    The Materials Project. Materials Data on K2PtS6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1696071

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                    The Materials Project. 2020.  
"Materials Data on K2PtS6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1696071.  https://www.osti.gov/servlets/purl/1696071. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1696071,

  title        = {Materials Data on K2PtS6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {K2PtS6 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. K1+ is bonded in a 6-coordinate geometry to six S+0.67- atoms. There are a spread of K–S bond distances ranging from 3.22–3.44 Å. Pt2+ is bonded in a distorted hexagonal planar geometry to six S+0.67- atoms. All Pt–S bond lengths are 2.39 Å. There are two inequivalent S+0.67- sites. In the first S+0.67- site, S+0.67- is bonded in a 3-coordinate geometry to two equivalent K1+ and one Pt2+ atom. In the second S+0.67- site, S+0.67- is bonded in a 4-coordinate geometry to two equivalent K1+, one Pt2+, and one S+0.67- atom. The S–S bond length is 2.11 Å.},

  doi          = {10.17188/1696071},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1696071

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