Materials Data on Mg3Au by Materials Project

doi:10.17188/1739398

Title: Materials Data on Mg3Au by Materials Project

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Abstract

Mg3Au is Sodium arsenide structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a trigonal planar geometry to three equivalent Au atoms. All Mg–Au bond lengths are 2.72 Å. In the second Mg site, Mg is bonded in a 1-coordinate geometry to four equivalent Au atoms. There are one shorter (2.81 Å) and three longer (3.09 Å) Mg–Au bond lengths. Au is bonded in a 5-coordinate geometry to eleven Mg atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1078964

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; Mg3Au; Au-Mg

OSTI Identifier:: 1739398

DOI:: https://doi.org/10.17188/1739398

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                    The Materials Project. Materials Data on Mg3Au by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1739398.

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                    The Materials Project. Materials Data on Mg3Au by Materials Project.  United States.  doi:https://doi.org/10.17188/1739398

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                    The Materials Project. 2020.  
"Materials Data on Mg3Au by Materials Project".  United States.  doi:https://doi.org/10.17188/1739398.  https://www.osti.gov/servlets/purl/1739398. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1739398,

  title        = {Materials Data on Mg3Au by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg3Au is Sodium arsenide structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a trigonal planar geometry to three equivalent Au atoms. All Mg–Au bond lengths are 2.72 Å. In the second Mg site, Mg is bonded in a 1-coordinate geometry to four equivalent Au atoms. There are one shorter (2.81 Å) and three longer (3.09 Å) Mg–Au bond lengths. Au is bonded in a 5-coordinate geometry to eleven Mg atoms.},

  doi          = {10.17188/1739398},

  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/10.17188/1739398

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