Materials Data on Nd3(SiNi3)2 by Materials Project

doi:10.17188/1664897

Title: Materials Data on Nd3(SiNi3)2 by Materials Project

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Abstract

Nd3(Ni3Si)2 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Ni and four equivalent Si atoms. There are four shorter (2.87 Å) and four longer (2.98 Å) Nd–Ni bond lengths. All Nd–Si bond lengths are 3.17 Å. Ni is bonded in a 12-coordinate geometry to four equivalent Nd, four equivalent Ni, and two equivalent Si atoms. All Ni–Ni bond lengths are 2.58 Å. Both Ni–Si bond lengths are 2.45 Å. Si is bonded to six equivalent Nd and six equivalent Ni atoms to form a mixture of face and corner-sharing SiNd6Ni6 cuboctahedra.

Publication Date:: 2020-07-15

Other Number(s):: mp-1190765

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Nd-Ni-Si; Nd3(SiNi3)2; crystal structure

OSTI Identifier:: 1664897

DOI:: https://doi.org/10.17188/1664897

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                    Materials Data on Nd3(SiNi3)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1664897.

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                    Materials Data on Nd3(SiNi3)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1664897

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                    2020.  
"Materials Data on Nd3(SiNi3)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1664897.  https://www.osti.gov/servlets/purl/1664897. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1664897,

  title        = {Materials Data on Nd3(SiNi3)2 by Materials Project},

  
  abstractNote = {Nd3(Ni3Si)2 crystallizes in the cubic Im-3m space group. The structure is three-dimensional. Nd is bonded in a 12-coordinate geometry to eight equivalent Ni and four equivalent Si atoms. There are four shorter (2.87 Å) and four longer (2.98 Å) Nd–Ni bond lengths. All Nd–Si bond lengths are 3.17 Å. Ni is bonded in a 12-coordinate geometry to four equivalent Nd, four equivalent Ni, and two equivalent Si atoms. All Ni–Ni bond lengths are 2.58 Å. Both Ni–Si bond lengths are 2.45 Å. Si is bonded to six equivalent Nd and six equivalent Ni atoms to form a mixture of face and corner-sharing SiNd6Ni6 cuboctahedra.},

  doi          = {10.17188/1664897},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1664897

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