Materials Data on NbCr3 by Materials Project

doi:10.17188/1317559

Title: Materials Data on NbCr3 by Materials Project

Dataset
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Abstract

CrCr2Nb is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Nb is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are eight shorter (2.58 Å) and six longer (2.98 Å) Nb–Cr bond lengths. There are two inequivalent Cr sites. In the first Cr site, Cr is bonded in a distorted body-centered cubic geometry to four equivalent Nb and four equivalent Cr atoms. All Cr–Cr bond lengths are 2.58 Å. In the second Cr site, Cr is bonded in a distorted body-centered cubic geometry to six equivalent Nb and eight equivalent Cr atoms.

Publication Date:: 2020-07-18

Other Number(s):: mp-999390

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-Nb; NbCr3; crystal structure

OSTI Identifier:: 1317559

DOI:: https://doi.org/10.17188/1317559

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                    Materials Data on NbCr3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1317559.

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                    Materials Data on NbCr3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1317559

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                    2020.  
"Materials Data on NbCr3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1317559.  https://www.osti.gov/servlets/purl/1317559. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1317559,

  title        = {Materials Data on NbCr3 by Materials Project},

  
  abstractNote = {CrCr2Nb is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Nb is bonded in a distorted body-centered cubic geometry to fourteen Cr atoms. There are eight shorter (2.58 Å) and six longer (2.98 Å) Nb–Cr bond lengths. There are two inequivalent Cr sites. In the first Cr site, Cr is bonded in a distorted body-centered cubic geometry to four equivalent Nb and four equivalent Cr atoms. All Cr–Cr bond lengths are 2.58 Å. In the second Cr site, Cr is bonded in a distorted body-centered cubic geometry to six equivalent Nb and eight equivalent Cr atoms.},

  doi          = {10.17188/1317559},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1317559

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