Materials Data on Mg5Pt by Materials Project

doi:10.17188/1748585

Title: Materials Data on Mg5Pt by Materials Project

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Abstract

Mg5Pt crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a 2-coordinate geometry to three equivalent Mg and two equivalent Pt atoms. There are two shorter (3.11 Å) and one longer (3.35 Å) Mg–Mg bond lengths. Both Mg–Pt bond lengths are 2.80 Å. In the second Mg site, Mg is bonded to twelve Mg atoms to form a mixture of edge, corner, and face-sharing MgMg12 cuboctahedra. There are four shorter (3.03 Å) and two longer (3.33 Å) Mg–Mg bond lengths. In the third Mg site, Mg is bonded in a 2-coordinate geometry to two equivalent Mg and two equivalent Pt atoms. Both Mg–Pt bond lengths are 2.71 Å. Pt is bonded in a body-centered cubic geometry to eight Mg atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1185838

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; Mg5Pt; Mg-Pt

OSTI Identifier:: 1748585

DOI:: https://doi.org/10.17188/1748585

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                    The Materials Project. Materials Data on Mg5Pt by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1748585.

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                    The Materials Project. Materials Data on Mg5Pt by Materials Project.  United States.  doi:https://doi.org/10.17188/1748585

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                    The Materials Project. 2020.  
"Materials Data on Mg5Pt by Materials Project".  United States.  doi:https://doi.org/10.17188/1748585.  https://www.osti.gov/servlets/purl/1748585. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1748585,

  title        = {Materials Data on Mg5Pt by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg5Pt crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a 2-coordinate geometry to three equivalent Mg and two equivalent Pt atoms. There are two shorter (3.11 Å) and one longer (3.35 Å) Mg–Mg bond lengths. Both Mg–Pt bond lengths are 2.80 Å. In the second Mg site, Mg is bonded to twelve Mg atoms to form a mixture of edge, corner, and face-sharing MgMg12 cuboctahedra. There are four shorter (3.03 Å) and two longer (3.33 Å) Mg–Mg bond lengths. In the third Mg site, Mg is bonded in a 2-coordinate geometry to two equivalent Mg and two equivalent Pt atoms. Both Mg–Pt bond lengths are 2.71 Å. Pt is bonded in a body-centered cubic geometry to eight Mg atoms.},

  doi          = {10.17188/1748585},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1748585

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