Materials Data on Mg2Zn by Materials Project

doi:10.17188/1722334

Title: Materials Data on Mg2Zn by Materials Project

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Abstract

Mg2Zn crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to nine Mg and three equivalent Zn atoms to form a mixture of distorted edge, face, and corner-sharing MgMg9Zn3 cuboctahedra. There are a spread of Mg–Mg bond distances ranging from 3.02–3.13 Å. There are two shorter (2.95 Å) and one longer (3.08 Å) Mg–Zn bond lengths. In the second Mg site, Mg is bonded to seven Mg and five equivalent Zn atoms to form distorted MgMg7Zn5 cuboctahedra that share corners with twelve MgMg9Zn3 cuboctahedra, edges with thirteen MgMg9Zn3 cuboctahedra, and faces with twelve MgMg7Zn5 cuboctahedra. There are one shorter (2.90 Å) and two longer (3.11 Å) Mg–Mg bond lengths. There are a spread of Mg–Zn bond distances ranging from 2.96–3.07 Å. Zn is bonded in a 12-coordinate geometry to eight Mg atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-1094489

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; Mg2Zn; Mg-Zn

OSTI Identifier:: 1722334

DOI:: https://doi.org/10.17188/1722334

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                    The Materials Project. Materials Data on Mg2Zn by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722334.

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                    The Materials Project. Materials Data on Mg2Zn by Materials Project.  United States.  doi:https://doi.org/10.17188/1722334

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                    The Materials Project. 2020.  
"Materials Data on Mg2Zn by Materials Project".  United States.  doi:https://doi.org/10.17188/1722334.  https://www.osti.gov/servlets/purl/1722334. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1722334,

  title        = {Materials Data on Mg2Zn by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg2Zn crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to nine Mg and three equivalent Zn atoms to form a mixture of distorted edge, face, and corner-sharing MgMg9Zn3 cuboctahedra. There are a spread of Mg–Mg bond distances ranging from 3.02–3.13 Å. There are two shorter (2.95 Å) and one longer (3.08 Å) Mg–Zn bond lengths. In the second Mg site, Mg is bonded to seven Mg and five equivalent Zn atoms to form distorted MgMg7Zn5 cuboctahedra that share corners with twelve MgMg9Zn3 cuboctahedra, edges with thirteen MgMg9Zn3 cuboctahedra, and faces with twelve MgMg7Zn5 cuboctahedra. There are one shorter (2.90 Å) and two longer (3.11 Å) Mg–Mg bond lengths. There are a spread of Mg–Zn bond distances ranging from 2.96–3.07 Å. Zn is bonded in a 12-coordinate geometry to eight Mg atoms.},

  doi          = {10.17188/1722334},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1722334

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