Materials Data on Mg3Sb by Materials Project

doi:10.17188/1695796

Title: Materials Data on Mg3Sb by Materials Project

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Abstract

Mg3Sb crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to four equivalent Sb atoms to form a mixture of distorted edge and corner-sharing MgSb4 cuboctahedra. There are two shorter (3.18 Å) and two longer (3.23 Å) Mg–Sb bond lengths. In the second Mg site, Mg is bonded to three equivalent Sb atoms to form a mixture of distorted edge and corner-sharing MgSb3 cuboctahedra. There are one shorter (3.16 Å) and two longer (3.22 Å) Mg–Sb bond lengths. Sb is bonded to ten Mg atoms to form a mixture of distorted edge, corner, and face-sharing SbMg10 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1094538

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; Mg3Sb; Mg-Sb

OSTI Identifier:: 1695796

DOI:: https://doi.org/10.17188/1695796

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                    The Materials Project. Materials Data on Mg3Sb by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1695796.

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                    The Materials Project. Materials Data on Mg3Sb by Materials Project.  United States.  doi:https://doi.org/10.17188/1695796

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                    The Materials Project. 2020.  
"Materials Data on Mg3Sb by Materials Project".  United States.  doi:https://doi.org/10.17188/1695796.  https://www.osti.gov/servlets/purl/1695796. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1695796,

  title        = {Materials Data on Mg3Sb by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg3Sb crystallizes in the orthorhombic Imm2 space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to four equivalent Sb atoms to form a mixture of distorted edge and corner-sharing MgSb4 cuboctahedra. There are two shorter (3.18 Å) and two longer (3.23 Å) Mg–Sb bond lengths. In the second Mg site, Mg is bonded to three equivalent Sb atoms to form a mixture of distorted edge and corner-sharing MgSb3 cuboctahedra. There are one shorter (3.16 Å) and two longer (3.22 Å) Mg–Sb bond lengths. Sb is bonded to ten Mg atoms to form a mixture of distorted edge, corner, and face-sharing SbMg10 cuboctahedra.},

  doi          = {10.17188/1695796},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1695796

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