Materials Data on TmMg2 by Materials Project

doi:10.17188/1752606

Title: Materials Data on TmMg2 by Materials Project

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Abstract

TmMg2 is Cubic Laves structured and crystallizes in the trigonal R32 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 Tm atoms to form a mixture of edge, face, and corner-sharing MgTm6Mg6 cuboctahedra. All Mg–Mg bond lengths are 2.99 Å. All Mg–Tm bond lengths are 3.50 Å. In the second Mg site, Mg is bonded to six Mg and six equivalent Tm atoms to form a mixture of edge, face, and corner-sharing MgTm6Mg6 cuboctahedra. All Mg–Mg bond lengths are 2.98 Å. There are a spread of Mg–Tm bond distances ranging from 3.49–3.51 Å. Tm is bonded in a 12-coordinate geometry to twelve Mg and four equivalent Tm atoms. There are three shorter (3.65 Å) and one longer (3.67 Å) Tm–Tm bond lengths.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1187676

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; TmMg2; Mg-Tm

OSTI Identifier:: 1752606

DOI:: https://doi.org/10.17188/1752606

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                    The Materials Project. Materials Data on TmMg2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1752606.

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                    The Materials Project. Materials Data on TmMg2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1752606

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                    The Materials Project. 2020.  
"Materials Data on TmMg2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1752606.  https://www.osti.gov/servlets/purl/1752606. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1752606,

  title        = {Materials Data on TmMg2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TmMg2 is Cubic Laves structured and crystallizes in the trigonal R32 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 Tm atoms to form a mixture of edge, face, and corner-sharing MgTm6Mg6 cuboctahedra. All Mg–Mg bond lengths are 2.99 Å. All Mg–Tm bond lengths are 3.50 Å. In the second Mg site, Mg is bonded to six Mg and six equivalent Tm atoms to form a mixture of edge, face, and corner-sharing MgTm6Mg6 cuboctahedra. All Mg–Mg bond lengths are 2.98 Å. There are a spread of Mg–Tm bond distances ranging from 3.49–3.51 Å. Tm is bonded in a 12-coordinate geometry to twelve Mg and four equivalent Tm atoms. There are three shorter (3.65 Å) and one longer (3.67 Å) Tm–Tm bond lengths.},

  doi          = {10.17188/1752606},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1752606

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