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.

Authors:: The Materials Project

Publication Date:: 2020-07-24

Other Number(s):: mp-1008275

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; Cr3Ni; Cr-Ni

OSTI Identifier:: 1325023

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

Citation Formats


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

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

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                    The Materials Project. 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},

  author       = {The 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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