Materials Data on CrCu4NiSn2 by Materials Project

doi:10.17188/1716478

Title: Materials Data on CrCu4NiSn2 by Materials Project

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Abstract

CrNiCu4Sn2 is Tungsten-derived structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to eight Cu atoms. All Cr–Cu bond lengths are 2.68 Å. Ni is bonded in a distorted body-centered cubic geometry to eight Cu atoms. There are two shorter (2.63 Å) and six longer (2.66 Å) Ni–Cu bond lengths. There are three inequivalent Cu sites. In the first Cu site, Cu is bonded in a distorted body-centered cubic geometry to three equivalent Cr, one Ni, and four equivalent Sn atoms. There are three shorter (2.66 Å) and one longer (2.69 Å) Cu–Sn bond lengths. In the second Cu site, Cu is bonded in a distorted body-centered cubic geometry to one Cr, three equivalent Ni, and four equivalent Sn atoms. There are one shorter (2.62 Å) and three longer (2.67 Å) Cu–Sn bond lengths. In the third Cu site, Cu is bonded in a distorted body-centered cubic geometry to one Cr, three equivalent Ni, and four equivalent Sn atoms. There are one shorter (2.62 Å) and three longer (2.67 Å) Cu–Sn bond lengths. Sn is bonded in a distorted body-centered cubic geometry to eight Cu atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1226279

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; CrCu4NiSn2; Cr-Cu-Ni-Sn

OSTI Identifier:: 1716478

DOI:: https://doi.org/10.17188/1716478

Citation Formats


                    The Materials Project. Materials Data on CrCu4NiSn2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1716478.

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                    The Materials Project. Materials Data on CrCu4NiSn2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1716478

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                    The Materials Project. 2020.  
"Materials Data on CrCu4NiSn2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1716478.  https://www.osti.gov/servlets/purl/1716478. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1716478,

  title        = {Materials Data on CrCu4NiSn2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CrNiCu4Sn2 is Tungsten-derived structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Cr is bonded in a distorted body-centered cubic geometry to eight Cu atoms. All Cr–Cu bond lengths are 2.68 Å. Ni is bonded in a distorted body-centered cubic geometry to eight Cu atoms. There are two shorter (2.63 Å) and six longer (2.66 Å) Ni–Cu bond lengths. There are three inequivalent Cu sites. In the first Cu site, Cu is bonded in a distorted body-centered cubic geometry to three equivalent Cr, one Ni, and four equivalent Sn atoms. There are three shorter (2.66 Å) and one longer (2.69 Å) Cu–Sn bond lengths. In the second Cu site, Cu is bonded in a distorted body-centered cubic geometry to one Cr, three equivalent Ni, and four equivalent Sn atoms. There are one shorter (2.62 Å) and three longer (2.67 Å) Cu–Sn bond lengths. In the third Cu site, Cu is bonded in a distorted body-centered cubic geometry to one Cr, three equivalent Ni, and four equivalent Sn atoms. There are one shorter (2.62 Å) and three longer (2.67 Å) Cu–Sn bond lengths. Sn is bonded in a distorted body-centered cubic geometry to eight Cu atoms.},

  doi          = {10.17188/1716478},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1716478

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