Materials Data on K2Hg(CN)4 by Materials Project

doi:10.17188/1277428

Title: Materials Data on K2Hg(CN)4 by Materials Project

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Abstract

K2Hg(CN)4 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. K1+ is bonded to six equivalent N3- atoms to form distorted edge-sharing KN6 octahedra. All K–N bond lengths are 2.97 Å. Hg2+ is bonded to four equivalent C2+ atoms to form HgC4 tetrahedra that share corners with four equivalent NK3C tetrahedra. All Hg–C bond lengths are 2.21 Å. C2+ is bonded in a single-bond geometry to one Hg2+ and one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded to three equivalent K1+ and one C2+ atom to form distorted NK3C tetrahedra that share a cornercorner with one HgC4 tetrahedra, corners with nine equivalent NK3C tetrahedra, and edges with three equivalent NK3C tetrahedra.

Authors:: The Materials Project

Publication Date:: Mon Jul 20 00:00:00 EDT 2020

Other Number(s):: mp-6051

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; K2Hg(CN)4; C-Hg-K-N

OSTI Identifier:: 1277428

DOI:: https://doi.org/10.17188/1277428

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                    The Materials Project. Materials Data on K2Hg(CN)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1277428.

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                    The Materials Project. Materials Data on K2Hg(CN)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1277428

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                    The Materials Project. 2020.  
"Materials Data on K2Hg(CN)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1277428.  https://www.osti.gov/servlets/purl/1277428. Pub date:Mon Jul 20 00:00:00 EDT 2020

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@article{osti_1277428,

  title        = {Materials Data on K2Hg(CN)4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {K2Hg(CN)4 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. K1+ is bonded to six equivalent N3- atoms to form distorted edge-sharing KN6 octahedra. All K–N bond lengths are 2.97 Å. Hg2+ is bonded to four equivalent C2+ atoms to form HgC4 tetrahedra that share corners with four equivalent NK3C tetrahedra. All Hg–C bond lengths are 2.21 Å. C2+ is bonded in a single-bond geometry to one Hg2+ and one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded to three equivalent K1+ and one C2+ atom to form distorted NK3C tetrahedra that share a cornercorner with one HgC4 tetrahedra, corners with nine equivalent NK3C tetrahedra, and edges with three equivalent NK3C tetrahedra.},

  doi          = {10.17188/1277428},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon Jul 20 00:00:00 EDT 2020},

  month        = {Mon Jul 20 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1277428

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