Materials Data on Mg2Al3 by Materials Project

doi:10.17188/1719948

Title: Materials Data on Mg2Al3 by Materials Project

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Abstract

Al3Mg2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Mg is bonded in a 11-coordinate geometry to three equivalent Mg and eight Al atoms. There are one shorter (2.89 Å) and two longer (3.02 Å) Mg–Mg bond lengths. There are a spread of Mg–Al bond distances ranging from 2.87–3.24 Å. There are two inequivalent Al sites. In the first Al site, Al is bonded in a 10-coordinate geometry to five equivalent Mg and five Al atoms. There are one shorter (2.74 Å) and four longer (2.82 Å) Al–Al bond lengths. In the second Al site, Al is bonded in a 10-coordinate geometry to six equivalent Mg and four equivalent Al atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1210739

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; Mg2Al3; Al-Mg

OSTI Identifier:: 1719948

DOI:: https://doi.org/10.17188/1719948

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                    The Materials Project. Materials Data on Mg2Al3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1719948.

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                    The Materials Project. Materials Data on Mg2Al3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1719948

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                    The Materials Project. 2019.  
"Materials Data on Mg2Al3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1719948.  https://www.osti.gov/servlets/purl/1719948. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1719948,

  title        = {Materials Data on Mg2Al3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Al3Mg2 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. Mg is bonded in a 11-coordinate geometry to three equivalent Mg and eight Al atoms. There are one shorter (2.89 Å) and two longer (3.02 Å) Mg–Mg bond lengths. There are a spread of Mg–Al bond distances ranging from 2.87–3.24 Å. There are two inequivalent Al sites. In the first Al site, Al is bonded in a 10-coordinate geometry to five equivalent Mg and five Al atoms. There are one shorter (2.74 Å) and four longer (2.82 Å) Al–Al bond lengths. In the second Al site, Al is bonded in a 10-coordinate geometry to six equivalent Mg and four equivalent Al atoms.},

  doi          = {10.17188/1719948},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1719948

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