Materials Data on LiAl by Materials Project

doi:10.17188/1738211

Title: Materials Data on LiAl by Materials Project

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Abstract

LiAl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li is bonded in a 11-coordinate geometry to four equivalent Li and seven Al atoms. There are one shorter (2.86 Å) and three longer (2.95 Å) Li–Li bond lengths. There are one shorter (2.87 Å) and six longer (2.95 Å) Li–Al bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded in a 9-coordinate geometry to six equivalent Li and three equivalent Al atoms. All Al–Al bond lengths are 2.58 Å. In the second Al site, Al is bonded in a 11-coordinate geometry to eight equivalent Li and three equivalent Al atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-1079240

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; LiAl; Al-Li

OSTI Identifier:: 1738211

DOI:: https://doi.org/10.17188/1738211

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                    The Materials Project. Materials Data on LiAl by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1738211.

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                    The Materials Project. Materials Data on LiAl by Materials Project.  United States.  doi:https://doi.org/10.17188/1738211

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                    The Materials Project. 2020.  
"Materials Data on LiAl by Materials Project".  United States.  doi:https://doi.org/10.17188/1738211.  https://www.osti.gov/servlets/purl/1738211. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1738211,

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

  author       = {The Materials Project},

  abstractNote = {LiAl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li is bonded in a 11-coordinate geometry to four equivalent Li and seven Al atoms. There are one shorter (2.86 Å) and three longer (2.95 Å) Li–Li bond lengths. There are one shorter (2.87 Å) and six longer (2.95 Å) Li–Al bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded in a 9-coordinate geometry to six equivalent Li and three equivalent Al atoms. All Al–Al bond lengths are 2.58 Å. In the second Al site, Al is bonded in a 11-coordinate geometry to eight equivalent Li and three equivalent Al atoms.},

  doi          = {10.17188/1738211},

  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/10.17188/1738211

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