Materials Data on Mn3Sn by Materials Project

doi:10.17188/1350117

Title: Materials Data on Mn3Sn by Materials Project

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Abstract

Mn3Sn is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mn sites. In the first Mn site, Mn is bonded to four equivalent Mn and four equivalent Sn atoms to form a mixture of distorted edge, corner, and face-sharing MnMn4Sn4 tetrahedra. All Mn–Mn bond lengths are 2.65 Å. All Mn–Sn bond lengths are 2.65 Å. In the second Mn site, Mn is bonded in a 8-coordinate geometry to eight equivalent Mn and six equivalent Sn atoms. All Mn–Sn bond lengths are 3.06 Å. Sn is bonded in a distorted body-centered cubic geometry to fourteen Mn atoms.

Publication Date:: 2020-07-23

Other Number(s):: mp-1018023

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; Mn-Sn; Mn3Sn; crystal structure

OSTI Identifier:: 1350117

DOI:: https://doi.org/10.17188/1350117

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                    Materials Data on Mn3Sn by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1350117.

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                    Materials Data on Mn3Sn by Materials Project.  United States.  doi:https://doi.org/10.17188/1350117

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                    2020.  
"Materials Data on Mn3Sn by Materials Project".  United States.  doi:https://doi.org/10.17188/1350117.  https://www.osti.gov/servlets/purl/1350117. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1350117,

  title        = {Materials Data on Mn3Sn by Materials Project},

  
  abstractNote = {Mn3Sn is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mn sites. In the first Mn site, Mn is bonded to four equivalent Mn and four equivalent Sn atoms to form a mixture of distorted edge, corner, and face-sharing MnMn4Sn4 tetrahedra. All Mn–Mn bond lengths are 2.65 Å. All Mn–Sn bond lengths are 2.65 Å. In the second Mn site, Mn is bonded in a 8-coordinate geometry to eight equivalent Mn and six equivalent Sn atoms. All Mn–Sn bond lengths are 3.06 Å. Sn is bonded in a distorted body-centered cubic geometry to fourteen Mn atoms.},

  doi          = {10.17188/1350117},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1350117

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