Materials Data on LiMgBi by Materials Project

doi:10.17188/1275583

Title: Materials Data on LiMgBi by Materials Project

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Abstract

LiMgBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li is bonded to four equivalent Bi atoms to form LiBi4 tetrahedra that share corners with four equivalent MgBi4 tetrahedra, corners with twelve equivalent LiBi4 tetrahedra, and edges with six equivalent MgBi4 tetrahedra. All Li–Bi bond lengths are 2.97 Å. Mg is bonded to four equivalent Bi atoms to form MgBi4 tetrahedra that share corners with four equivalent LiBi4 tetrahedra, corners with twelve equivalent MgBi4 tetrahedra, and edges with six equivalent LiBi4 tetrahedra. All Mg–Bi bond lengths are 2.97 Å. Bi is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Mg atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-570213

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; LiMgBi; Bi-Li-Mg

OSTI Identifier:: 1275583

DOI:: https://doi.org/10.17188/1275583

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                    The Materials Project. Materials Data on LiMgBi by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1275583.

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                    The Materials Project. Materials Data on LiMgBi by Materials Project.  United States.  doi:https://doi.org/10.17188/1275583

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                    The Materials Project. 2020.  
"Materials Data on LiMgBi by Materials Project".  United States.  doi:https://doi.org/10.17188/1275583.  https://www.osti.gov/servlets/purl/1275583. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1275583,

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

  author       = {The Materials Project},

  abstractNote = {LiMgBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li is bonded to four equivalent Bi atoms to form LiBi4 tetrahedra that share corners with four equivalent MgBi4 tetrahedra, corners with twelve equivalent LiBi4 tetrahedra, and edges with six equivalent MgBi4 tetrahedra. All Li–Bi bond lengths are 2.97 Å. Mg is bonded to four equivalent Bi atoms to form MgBi4 tetrahedra that share corners with four equivalent LiBi4 tetrahedra, corners with twelve equivalent MgBi4 tetrahedra, and edges with six equivalent LiBi4 tetrahedra. All Mg–Bi bond lengths are 2.97 Å. Bi is bonded in a body-centered cubic geometry to four equivalent Li and four equivalent Mg atoms.},

  doi          = {10.17188/1275583},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1275583

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