Materials Data on MgAu3 by Materials Project

doi:10.17188/1750337

Title: Materials Data on MgAu3 by Materials Project

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Abstract

MgAu3 is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to twelve Au atoms to form a mixture of face, edge, and corner-sharing MgAu12 cuboctahedra. There are four shorter (2.88 Å) and eight longer (2.96 Å) Mg–Au bond lengths. There are two inequivalent Au sites. In the first Au site, Au is bonded in a square co-planar geometry to four equivalent Mg atoms. In the second Au site, Au is bonded to four equivalent Mg atoms to form a mixture of distorted edge and corner-sharing AuMg4 cuboctahedra.

Authors:: The Materials Project

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

Other Number(s):: mp-1185848

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; MgAu3; Au-Mg

OSTI Identifier:: 1750337

DOI:: https://doi.org/10.17188/1750337

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                    The Materials Project. Materials Data on MgAu3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1750337.

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                    The Materials Project. Materials Data on MgAu3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1750337

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                    The Materials Project. 2020.  
"Materials Data on MgAu3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1750337.  https://www.osti.gov/servlets/purl/1750337. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1750337,

  title        = {Materials Data on MgAu3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {MgAu3 is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Mg is bonded to twelve Au atoms to form a mixture of face, edge, and corner-sharing MgAu12 cuboctahedra. There are four shorter (2.88 Å) and eight longer (2.96 Å) Mg–Au bond lengths. There are two inequivalent Au sites. In the first Au site, Au is bonded in a square co-planar geometry to four equivalent Mg atoms. In the second Au site, Au is bonded to four equivalent Mg atoms to form a mixture of distorted edge and corner-sharing AuMg4 cuboctahedra.},

  doi          = {10.17188/1750337},

  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/10.17188/1750337

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