Materials Data on YbMg2 by Materials Project

doi:10.17188/1746833

Title: Materials Data on YbMg2 by Materials Project

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Abstract

Mg2Yb is Cubic Laves structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to six equivalent Mg and six equivalent Yb atoms to form a mixture of edge, face, and corner-sharing MgYb6Mg6 cuboctahedra. All Mg–Mg bond lengths are 3.10 Å. All Mg–Yb bond lengths are 3.63 Å. In the second Mg site, Mg is bonded to six Mg and six equivalent Yb atoms to form a mixture of edge, face, and corner-sharing MgYb6Mg6 cuboctahedra. All Mg–Mg bond lengths are 3.09 Å. There are four shorter (3.62 Å) and two longer (3.64 Å) Mg–Yb bond lengths. Yb is bonded in a 12-coordinate geometry to twelve Mg and four equivalent Yb atoms. There are one shorter (3.78 Å) and three longer (3.79 Å) Yb–Yb bond lengths.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1100782

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; YbMg2; Mg-Yb

OSTI Identifier:: 1746833

DOI:: https://doi.org/10.17188/1746833

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                    The Materials Project. Materials Data on YbMg2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1746833.

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                    The Materials Project. Materials Data on YbMg2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1746833

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                    The Materials Project. 2020.  
"Materials Data on YbMg2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1746833.  https://www.osti.gov/servlets/purl/1746833. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1746833,

  title        = {Materials Data on YbMg2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg2Yb is Cubic Laves structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded to six equivalent Mg and six equivalent Yb atoms to form a mixture of edge, face, and corner-sharing MgYb6Mg6 cuboctahedra. All Mg–Mg bond lengths are 3.10 Å. All Mg–Yb bond lengths are 3.63 Å. In the second Mg site, Mg is bonded to six Mg and six equivalent Yb atoms to form a mixture of edge, face, and corner-sharing MgYb6Mg6 cuboctahedra. All Mg–Mg bond lengths are 3.09 Å. There are four shorter (3.62 Å) and two longer (3.64 Å) Mg–Yb bond lengths. Yb is bonded in a 12-coordinate geometry to twelve Mg and four equivalent Yb atoms. There are one shorter (3.78 Å) and three longer (3.79 Å) Yb–Yb bond lengths.},

  doi          = {10.17188/1746833},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1746833

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