Materials Data on Mg16Al12Pb by Materials Project

doi:10.17188/1719856

Title: Materials Data on Mg16Al12Pb by Materials Project

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Abstract

Mg16Al12Pb crystallizes in the cubic I-43m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to seven Mg and five equivalent Al atoms. There are a spread of Mg–Mg bond distances ranging from 3.03–3.19 Å. There are a spread of Mg–Al bond distances ranging from 2.88–3.16 Å. In the second Mg site, Mg is bonded in a 10-coordinate geometry to three equivalent Mg, six equivalent Al, and one Pb atom. All Mg–Al bond lengths are 3.17 Å. The Mg–Pb bond length is 3.21 Å. Al is bonded in a 11-coordinate geometry to seven Mg, three equivalent Al, and one Pb atom. There are one shorter (2.76 Å) and two longer (2.82 Å) Al–Al bond lengths. The Al–Pb bond length is 3.28 Å. Pb is bonded in a 4-coordinate geometry to four equivalent Mg and twelve equivalent Al atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1185677

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; Mg16Al12Pb; Al-Mg-Pb

OSTI Identifier:: 1719856

DOI:: https://doi.org/10.17188/1719856

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                    The Materials Project. Materials Data on Mg16Al12Pb by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1719856.

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                    The Materials Project. Materials Data on Mg16Al12Pb by Materials Project.  United States.  doi:https://doi.org/10.17188/1719856

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                    The Materials Project. 2020.  
"Materials Data on Mg16Al12Pb by Materials Project".  United States.  doi:https://doi.org/10.17188/1719856.  https://www.osti.gov/servlets/purl/1719856. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1719856,

  title        = {Materials Data on Mg16Al12Pb by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg16Al12Pb crystallizes in the cubic I-43m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a 12-coordinate geometry to seven Mg and five equivalent Al atoms. There are a spread of Mg–Mg bond distances ranging from 3.03–3.19 Å. There are a spread of Mg–Al bond distances ranging from 2.88–3.16 Å. In the second Mg site, Mg is bonded in a 10-coordinate geometry to three equivalent Mg, six equivalent Al, and one Pb atom. All Mg–Al bond lengths are 3.17 Å. The Mg–Pb bond length is 3.21 Å. Al is bonded in a 11-coordinate geometry to seven Mg, three equivalent Al, and one Pb atom. There are one shorter (2.76 Å) and two longer (2.82 Å) Al–Al bond lengths. The Al–Pb bond length is 3.28 Å. Pb is bonded in a 4-coordinate geometry to four equivalent Mg and twelve equivalent Al atoms.},

  doi          = {10.17188/1719856},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1719856

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