Materials Data on Cr3Ni by Materials Project

doi:10.17188/1325023

Title: Materials Data on Cr3Ni by Materials Project

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Abstract

Cr3Ni is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Cr sites. In the first Cr site, Cr is bonded in a distorted body-centered cubic geometry to four equivalent Cr and four equivalent Ni atoms. All Cr–Cr bond lengths are 2.49 Å. All Cr–Ni bond lengths are 2.49 Å. In the second Cr site, Cr is bonded in a 8-coordinate geometry to eight equivalent Cr and six equivalent Ni atoms. All Cr–Ni bond lengths are 2.88 Å. Ni is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms.

Publication Date:: 2020-07-24

Other Number(s):: mp-1008275

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; Cr-Ni; Cr3Ni; crystal structure

OSTI Identifier:: 1325023

DOI:: https://doi.org/10.17188/1325023

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                    Materials Data on Cr3Ni by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1325023.

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                    Materials Data on Cr3Ni by Materials Project.  United States.  doi:https://doi.org/10.17188/1325023

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                    2020.  
"Materials Data on Cr3Ni by Materials Project".  United States.  doi:https://doi.org/10.17188/1325023.  https://www.osti.gov/servlets/purl/1325023. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1325023,

  title        = {Materials Data on Cr3Ni by Materials Project},

  
  abstractNote = {Cr3Ni is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Cr sites. In the first Cr site, Cr is bonded in a distorted body-centered cubic geometry to four equivalent Cr and four equivalent Ni atoms. All Cr–Cr bond lengths are 2.49 Å. All Cr–Ni bond lengths are 2.49 Å. In the second Cr site, Cr is bonded in a 8-coordinate geometry to eight equivalent Cr and six equivalent Ni atoms. All Cr–Ni bond lengths are 2.88 Å. Ni is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms.},

  doi          = {10.17188/1325023},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1325023

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