Materials Data on ZnAu2(CN)4 by Materials Project

doi:10.17188/1280687

Title: Materials Data on ZnAu2(CN)4 by Materials Project

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Abstract

Au2Zn(CN)4 crystallizes in the hexagonal P6_222 space group. The structure is three-dimensional and consists of two Au2Zn(CN)4 frameworks. Au1+ is bonded in a distorted linear geometry to two C2+ atoms. Both Au–C bond lengths are 1.99 Å. Zn2+ is bonded in a tetrahedral geometry to four N3- atoms. All Zn–N bond lengths are 1.98 Å. There are two inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a distorted single-bond geometry to one Au1+ and one N3- atom. The C–N bond length is 1.17 Å. In the second C2+ site, C2+ is bonded in a distorted single-bond geometry to one Au1+ and one N3- atom. The C–N bond length is 1.17 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the second N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom.

Authors:: The Materials Project

Publication Date:: 2020-04-29

Other Number(s):: mp-647252

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; ZnAu2(CN)4; Au-C-N-Zn

OSTI Identifier:: 1280687

DOI:: https://doi.org/10.17188/1280687

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                    The Materials Project. Materials Data on ZnAu2(CN)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1280687.

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                    The Materials Project. Materials Data on ZnAu2(CN)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1280687

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                    The Materials Project. 2020.  
"Materials Data on ZnAu2(CN)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1280687.  https://www.osti.gov/servlets/purl/1280687. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1280687,

  title        = {Materials Data on ZnAu2(CN)4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Au2Zn(CN)4 crystallizes in the hexagonal P6_222 space group. The structure is three-dimensional and consists of two Au2Zn(CN)4 frameworks. Au1+ is bonded in a distorted linear geometry to two C2+ atoms. Both Au–C bond lengths are 1.99 Å. Zn2+ is bonded in a tetrahedral geometry to four N3- atoms. All Zn–N bond lengths are 1.98 Å. There are two inequivalent C2+ sites. In the first C2+ site, C2+ is bonded in a distorted single-bond geometry to one Au1+ and one N3- atom. The C–N bond length is 1.17 Å. In the second C2+ site, C2+ is bonded in a distorted single-bond geometry to one Au1+ and one N3- atom. The C–N bond length is 1.17 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom. In the second N3- site, N3- is bonded in a linear geometry to one Zn2+ and one C2+ atom.},

  doi          = {10.17188/1280687},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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