Materials Data on Pr5Sn3Au by Materials Project

doi:10.17188/1706948

Title: Materials Data on Pr5Sn3Au by Materials Project

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Abstract

Pr5AuSn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 7-coordinate geometry to two equivalent Au and five equivalent Sn atoms. Both Pr–Au bond lengths are 3.11 Å. There are a spread of Pr–Sn bond distances ranging from 3.27–3.59 Å. In the second Pr site, Pr is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All Pr–Sn bond lengths are 3.46 Å. Au is bonded to six equivalent Pr atoms to form face-sharing AuPr6 octahedra. Sn is bonded in a 9-coordinate geometry to nine Pr atoms.

Publication Date:: 2020-05-02

Other Number(s):: mp-1209635

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; Au-Pr-Sn; Pr5Sn3Au; crystal structure

OSTI Identifier:: 1706948

DOI:: https://doi.org/10.17188/1706948

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                    Materials Data on Pr5Sn3Au by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1706948.

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                    Materials Data on Pr5Sn3Au by Materials Project.  United States.  doi:https://doi.org/10.17188/1706948

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                    2020.  
"Materials Data on Pr5Sn3Au by Materials Project".  United States.  doi:https://doi.org/10.17188/1706948.  https://www.osti.gov/servlets/purl/1706948. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1706948,

  title        = {Materials Data on Pr5Sn3Au by Materials Project},

  
  abstractNote = {Pr5AuSn3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Pr sites. In the first Pr site, Pr is bonded in a 7-coordinate geometry to two equivalent Au and five equivalent Sn atoms. Both Pr–Au bond lengths are 3.11 Å. There are a spread of Pr–Sn bond distances ranging from 3.27–3.59 Å. In the second Pr site, Pr is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All Pr–Sn bond lengths are 3.46 Å. Au is bonded to six equivalent Pr atoms to form face-sharing AuPr6 octahedra. Sn is bonded in a 9-coordinate geometry to nine Pr atoms.},

  doi          = {10.17188/1706948},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1706948

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