Materials Data on Li2GeAu by Materials Project

doi:10.17188/1203702

Title: Materials Data on Li2GeAu by Materials Project

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Abstract

Li2AuGe crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to six equivalent Au and four equivalent Ge atoms to form distorted LiGe4Au6 tetrahedra that share corners with eighteen LiAu4 tetrahedra and faces with sixteen LiGe4Au6 tetrahedra. All Li–Au bond lengths are 3.13 Å. All Li–Ge bond lengths are 2.71 Å. In the second Li site, Li is bonded to four equivalent Au atoms to form distorted LiAu4 tetrahedra that share corners with twenty-four LiAu4 tetrahedra and faces with four equivalent LiGe4Au6 tetrahedra. All Li–Au bond lengths are 2.71 Å. Au is bonded in a distorted body-centered cubic geometry to ten Li and four equivalent Ge atoms. All Au–Ge bond lengths are 2.71 Å. Ge is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Au atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-2935

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; Li2GeAu; Au-Ge-Li

OSTI Identifier:: 1203702

DOI:: https://doi.org/10.17188/1203702

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                    The Materials Project. Materials Data on Li2GeAu by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1203702.

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                    The Materials Project. Materials Data on Li2GeAu by Materials Project.  United States.  doi:https://doi.org/10.17188/1203702

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                    The Materials Project. 2020.  
"Materials Data on Li2GeAu by Materials Project".  United States.  doi:https://doi.org/10.17188/1203702.  https://www.osti.gov/servlets/purl/1203702. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1203702,

  title        = {Materials Data on Li2GeAu by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Li2AuGe crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Li sites. In the first Li site, Li is bonded to six equivalent Au and four equivalent Ge atoms to form distorted LiGe4Au6 tetrahedra that share corners with eighteen LiAu4 tetrahedra and faces with sixteen LiGe4Au6 tetrahedra. All Li–Au bond lengths are 3.13 Å. All Li–Ge bond lengths are 2.71 Å. In the second Li site, Li is bonded to four equivalent Au atoms to form distorted LiAu4 tetrahedra that share corners with twenty-four LiAu4 tetrahedra and faces with four equivalent LiGe4Au6 tetrahedra. All Li–Au bond lengths are 2.71 Å. Au is bonded in a distorted body-centered cubic geometry to ten Li and four equivalent Ge atoms. All Au–Ge bond lengths are 2.71 Å. Ge is bonded in a distorted body-centered cubic geometry to four equivalent Li and four equivalent Au atoms.},

  doi          = {10.17188/1203702},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1203702

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