Materials Data on LiAlAu by Materials Project

doi:10.17188/1664157

Title: Materials Data on LiAlAu by Materials Project

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Abstract

LiAuAl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li is bonded in a 11-coordinate geometry to six equivalent Au and five equivalent Al atoms. All Li–Au bond lengths are 2.88 Å. There are three shorter (2.52 Å) and two longer (2.77 Å) Li–Al bond lengths. Au is bonded to six equivalent Li, two equivalent Au, and six equivalent Al atoms to form a mixture of distorted edge, face, and corner-sharing AuLi6Al6Au2 cuboctahedra. Both Au–Au bond lengths are 2.77 Å. All Au–Al bond lengths are 2.88 Å. Al is bonded in a 11-coordinate geometry to five equivalent Li and six equivalent Au atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1206281

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; LiAlAu; Al-Au-Li

OSTI Identifier:: 1664157

DOI:: https://doi.org/10.17188/1664157

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                    The Materials Project. Materials Data on LiAlAu by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1664157.

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                    The Materials Project. Materials Data on LiAlAu by Materials Project.  United States.  doi:https://doi.org/10.17188/1664157

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                    The Materials Project. 2019.  
"Materials Data on LiAlAu by Materials Project".  United States.  doi:https://doi.org/10.17188/1664157.  https://www.osti.gov/servlets/purl/1664157. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1664157,

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

  author       = {The Materials Project},

  abstractNote = {LiAuAl crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Li is bonded in a 11-coordinate geometry to six equivalent Au and five equivalent Al atoms. All Li–Au bond lengths are 2.88 Å. There are three shorter (2.52 Å) and two longer (2.77 Å) Li–Al bond lengths. Au is bonded to six equivalent Li, two equivalent Au, and six equivalent Al atoms to form a mixture of distorted edge, face, and corner-sharing AuLi6Al6Au2 cuboctahedra. Both Au–Au bond lengths are 2.77 Å. All Au–Al bond lengths are 2.88 Å. Al is bonded in a 11-coordinate geometry to five equivalent Li and six equivalent Au atoms.},

  doi          = {10.17188/1664157},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1664157

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