Materials Data on Fe2SiNi by Materials Project

doi:10.17188/1686659

Title: Materials Data on Fe2SiNi by Materials Project

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Abstract

Fe2NiSi is Tungsten-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 8-coordinate geometry to four equivalent Fe, four equivalent Ni, and six equivalent Si atoms. All Fe–Fe bond lengths are 2.44 Å. All Fe–Ni bond lengths are 2.44 Å. All Fe–Si bond lengths are 2.82 Å. In the second Fe site, Fe is bonded in a 8-coordinate geometry to four equivalent Fe, six equivalent Ni, and four equivalent Si atoms. All Fe–Ni bond lengths are 2.82 Å. All Fe–Si bond lengths are 2.44 Å. Ni is bonded in a distorted body-centered cubic geometry to ten Fe and four equivalent Si atoms. All Ni–Si bond lengths are 2.44 Å. Si is bonded in a distorted body-centered cubic geometry to ten Fe and four equivalent Ni atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1207121

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; Fe2SiNi; Fe-Ni-Si

OSTI Identifier:: 1686659

DOI:: https://doi.org/10.17188/1686659

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                    The Materials Project. Materials Data on Fe2SiNi by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1686659.

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                    The Materials Project. Materials Data on Fe2SiNi by Materials Project.  United States.  doi:https://doi.org/10.17188/1686659

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                    The Materials Project. 2020.  
"Materials Data on Fe2SiNi by Materials Project".  United States.  doi:https://doi.org/10.17188/1686659.  https://www.osti.gov/servlets/purl/1686659. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1686659,

  title        = {Materials Data on Fe2SiNi by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Fe2NiSi is Tungsten-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Fe sites. In the first Fe site, Fe is bonded in a 8-coordinate geometry to four equivalent Fe, four equivalent Ni, and six equivalent Si atoms. All Fe–Fe bond lengths are 2.44 Å. All Fe–Ni bond lengths are 2.44 Å. All Fe–Si bond lengths are 2.82 Å. In the second Fe site, Fe is bonded in a 8-coordinate geometry to four equivalent Fe, six equivalent Ni, and four equivalent Si atoms. All Fe–Ni bond lengths are 2.82 Å. All Fe–Si bond lengths are 2.44 Å. Ni is bonded in a distorted body-centered cubic geometry to ten Fe and four equivalent Si atoms. All Ni–Si bond lengths are 2.44 Å. Si is bonded in a distorted body-centered cubic geometry to ten Fe and four equivalent Ni atoms.},

  doi          = {10.17188/1686659},

  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/10.17188/1686659

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