Materials Data on Pr5AgSn3 by Materials Project

doi:10.17188/1652039

Title: Materials Data on Pr5AgSn3 by Materials Project

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Abstract

Pr5AgSn3 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 Ag and five equivalent Sn atoms. Both Pr–Ag bond lengths are 3.15 Å. There are a spread of Pr–Sn bond distances ranging from 3.27–3.57 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 3.47 Å. Ag is bonded to six equivalent Pr atoms to form face-sharing AgPr6 octahedra. Sn is bonded in a 9-coordinate geometry to nine Pr atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1209345

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; Pr5AgSn3; Ag-Pr-Sn

OSTI Identifier:: 1652039

DOI:: https://doi.org/10.17188/1652039

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                    The Materials Project. Materials Data on Pr5AgSn3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1652039.

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                    The Materials Project. Materials Data on Pr5AgSn3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1652039

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                    The Materials Project. 2020.  
"Materials Data on Pr5AgSn3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1652039.  https://www.osti.gov/servlets/purl/1652039. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1652039,

  title        = {Materials Data on Pr5AgSn3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Pr5AgSn3 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 Ag and five equivalent Sn atoms. Both Pr–Ag bond lengths are 3.15 Å. There are a spread of Pr–Sn bond distances ranging from 3.27–3.57 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 3.47 Å. Ag is bonded to six equivalent Pr atoms to form face-sharing AgPr6 octahedra. Sn is bonded in a 9-coordinate geometry to nine Pr atoms.},

  doi          = {10.17188/1652039},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1652039

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