Materials Data on Mg3ZnC by Materials Project

doi:10.17188/1186712

Title: Materials Data on Mg3ZnC by Materials Project

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Abstract

Mg3ZnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg is bonded in a linear geometry to four equivalent Zn and two equivalent C atoms. All Mg–Zn bond lengths are 3.12 Å. Both Mg–C bond lengths are 2.20 Å. Zn is bonded to twelve equivalent Mg atoms to form ZnMg12 cuboctahedra that share corners with twelve equivalent ZnMg12 cuboctahedra, faces with six equivalent ZnMg12 cuboctahedra, and faces with eight equivalent CMg6 octahedra. C is bonded to six equivalent Mg atoms to form CMg6 octahedra that share corners with six equivalent CMg6 octahedra and faces with eight equivalent ZnMg12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-10185

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; Mg3ZnC; C-Mg-Zn

OSTI Identifier:: 1186712

DOI:: https://doi.org/10.17188/1186712

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                    The Materials Project. Materials Data on Mg3ZnC by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1186712.

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                    The Materials Project. Materials Data on Mg3ZnC by Materials Project.  United States.  doi:https://doi.org/10.17188/1186712

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                    The Materials Project. 2020.  
"Materials Data on Mg3ZnC by Materials Project".  United States.  doi:https://doi.org/10.17188/1186712.  https://www.osti.gov/servlets/purl/1186712. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1186712,

  title        = {Materials Data on Mg3ZnC by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg3ZnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg is bonded in a linear geometry to four equivalent Zn and two equivalent C atoms. All Mg–Zn bond lengths are 3.12 Å. Both Mg–C bond lengths are 2.20 Å. Zn is bonded to twelve equivalent Mg atoms to form ZnMg12 cuboctahedra that share corners with twelve equivalent ZnMg12 cuboctahedra, faces with six equivalent ZnMg12 cuboctahedra, and faces with eight equivalent CMg6 octahedra. C is bonded to six equivalent Mg atoms to form CMg6 octahedra that share corners with six equivalent CMg6 octahedra and faces with eight equivalent ZnMg12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},

  doi          = {10.17188/1186712},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1186712

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