Materials Data on CuNi3 by Materials Project

doi:10.17188/1685849

Title: Materials Data on CuNi3 by Materials Project

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Abstract

Ni3Cu is Tungsten-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a distorted body-centered cubic geometry to six Ni and two equivalent Cu atoms. There are two shorter (2.39 Å) and four longer (2.43 Å) Ni–Ni bond lengths. Both Ni–Cu bond lengths are 2.46 Å. In the second Ni site, Ni is bonded in a distorted body-centered cubic geometry to eight Ni atoms. All Ni–Ni bond lengths are 2.43 Å. Cu is bonded in a distorted body-centered cubic geometry to four equivalent Ni and four equivalent Cu atoms. All Cu–Cu bond lengths are 2.43 Å.

Publication Date:: Sat May 02 04:00:00 UTC 2020

Other Number(s):: mp-1225694

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; Cu-Ni; CuNi3; crystal structure

OSTI Identifier:: 1685849

DOI:: https://doi.org/10.17188/1685849

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                    Materials Data on CuNi3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1685849.

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                    Materials Data on CuNi3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1685849

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                    2020.  
"Materials Data on CuNi3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1685849.  https://www.osti.gov/servlets/purl/1685849. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1685849,

  title        = {Materials Data on CuNi3 by Materials Project},

  
  abstractNote = {Ni3Cu is Tungsten-derived structured and crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. there are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a distorted body-centered cubic geometry to six Ni and two equivalent Cu atoms. There are two shorter (2.39 Å) and four longer (2.43 Å) Ni–Ni bond lengths. Both Ni–Cu bond lengths are 2.46 Å. In the second Ni site, Ni is bonded in a distorted body-centered cubic geometry to eight Ni atoms. All Ni–Ni bond lengths are 2.43 Å. Cu is bonded in a distorted body-centered cubic geometry to four equivalent Ni and four equivalent Cu atoms. All Cu–Cu bond lengths are 2.43 Å.},

  doi          = {10.17188/1685849},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 04:00:00 UTC 2020},

  month        = {Sat May 02 04:00:00 UTC 2020}

}

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DOI: https://doi.org/10.17188/1685849

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