Materials Data on LiMgN by Materials Project

doi:10.17188/1207436

Title: Materials Data on LiMgN by Materials Project

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Abstract

LiMgN is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent N3- atoms to form LiN4 tetrahedra that share corners with four equivalent MgN4 tetrahedra, corners with twelve equivalent LiN4 tetrahedra, and edges with six equivalent MgN4 tetrahedra. All Li–N bond lengths are 2.17 Å. Mg2+ is bonded to four equivalent N3- atoms to form MgN4 tetrahedra that share corners with four equivalent LiN4 tetrahedra, corners with twelve equivalent MgN4 tetrahedra, and edges with six equivalent LiN4 tetrahedra. All Mg–N bond lengths are 2.17 Å. N3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Mg2+ atoms.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-37906

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; LiMgN; Li-Mg-N

OSTI Identifier:: 1207436

DOI:: https://doi.org/10.17188/1207436

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                    The Materials Project. Materials Data on LiMgN by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1207436.

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                    The Materials Project. Materials Data on LiMgN by Materials Project.  United States.  doi:https://doi.org/10.17188/1207436

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                    The Materials Project. 2020.  
"Materials Data on LiMgN by Materials Project".  United States.  doi:https://doi.org/10.17188/1207436.  https://www.osti.gov/servlets/purl/1207436. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1207436,

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

  author       = {The Materials Project},

  abstractNote = {LiMgN is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Li1+ is bonded to four equivalent N3- atoms to form LiN4 tetrahedra that share corners with four equivalent MgN4 tetrahedra, corners with twelve equivalent LiN4 tetrahedra, and edges with six equivalent MgN4 tetrahedra. All Li–N bond lengths are 2.17 Å. Mg2+ is bonded to four equivalent N3- atoms to form MgN4 tetrahedra that share corners with four equivalent LiN4 tetrahedra, corners with twelve equivalent MgN4 tetrahedra, and edges with six equivalent LiN4 tetrahedra. All Mg–N bond lengths are 2.17 Å. N3- is bonded in a body-centered cubic geometry to four equivalent Li1+ and four equivalent Mg2+ atoms.},

  doi          = {10.17188/1207436},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1207436

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