Materials Data on Zn3SiNi2 by Materials Project

doi:10.17188/1192420

Title: Materials Data on Zn3SiNi2 by Materials Project

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Abstract

Ni2SiZn3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ni is bonded in a 12-coordinate geometry to three equivalent Ni, six equivalent Zn, and three equivalent Si atoms. All Ni–Ni bond lengths are 2.59 Å. There are three shorter (2.50 Å) and three longer (2.76 Å) Ni–Zn bond lengths. All Ni–Si bond lengths are 2.33 Å. Zn is bonded in a 2-coordinate geometry to four equivalent Ni, eight equivalent Zn, and two equivalent Si atoms. There are four shorter (2.83 Å) and four longer (2.84 Å) Zn–Zn bond lengths. Both Zn–Si bond lengths are 2.76 Å. Si is bonded to six equivalent Ni and six equivalent Zn atoms to form face-sharing SiZn6Ni6 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-17260

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; Zn3SiNi2; Ni-Si-Zn

OSTI Identifier:: 1192420

DOI:: https://doi.org/10.17188/1192420

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                    The Materials Project. Materials Data on Zn3SiNi2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1192420.

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                    The Materials Project. Materials Data on Zn3SiNi2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1192420

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                    The Materials Project. 2020.  
"Materials Data on Zn3SiNi2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1192420.  https://www.osti.gov/servlets/purl/1192420. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1192420,

  title        = {Materials Data on Zn3SiNi2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ni2SiZn3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Ni is bonded in a 12-coordinate geometry to three equivalent Ni, six equivalent Zn, and three equivalent Si atoms. All Ni–Ni bond lengths are 2.59 Å. There are three shorter (2.50 Å) and three longer (2.76 Å) Ni–Zn bond lengths. All Ni–Si bond lengths are 2.33 Å. Zn is bonded in a 2-coordinate geometry to four equivalent Ni, eight equivalent Zn, and two equivalent Si atoms. There are four shorter (2.83 Å) and four longer (2.84 Å) Zn–Zn bond lengths. Both Zn–Si bond lengths are 2.76 Å. Si is bonded to six equivalent Ni and six equivalent Zn atoms to form face-sharing SiZn6Ni6 cuboctahedra.},

  doi          = {10.17188/1192420},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1192420

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