Materials Data on Gd3Ho by Materials Project

doi:10.17188/1745199

Title: Materials Data on Gd3Ho by Materials Project

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Abstract

HoGd3 is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ho is bonded to twelve Gd atoms to form HoGd12 cuboctahedra that share corners with four equivalent HoGd12 cuboctahedra, corners with eight equivalent GdGd8Ho4 cuboctahedra, edges with eight equivalent HoGd12 cuboctahedra, edges with sixteen equivalent GdGd8Ho4 cuboctahedra, faces with four equivalent HoGd12 cuboctahedra, and faces with fourteen GdGd8Ho4 cuboctahedra. There are four shorter (3.55 Å) and eight longer (3.56 Å) Ho–Gd bond lengths. There are two inequivalent Gd sites. In the first Gd site, Gd is bonded to four equivalent Ho and eight Gd atoms to form GdGd8Ho4 cuboctahedra that share corners with twelve equivalent GdGd8Ho4 cuboctahedra, edges with eight equivalent HoGd12 cuboctahedra, edges with sixteen GdGd8Ho4 cuboctahedra, faces with four equivalent HoGd12 cuboctahedra, and faces with fourteen GdGd8Ho4 cuboctahedra. There are four shorter (3.55 Å) and four longer (3.56 Å) Gd–Gd bond lengths. In the second Gd site, Gd is bonded to four equivalent Ho and eight equivalent Gd atoms to form GdGd8Ho4 cuboctahedra that share corners with four equivalent GdGd8Ho4 cuboctahedra, corners with eight equivalent HoGd12 cuboctahedra, edges with twenty-four GdGd8Ho4 cuboctahedra, faces with six equivalent HoGd12 cuboctahedra, and faces withmore » twelve GdGd8Ho4 cuboctahedra.« less

Authors:: The Materials Project

Publication Date:: 2020-06-05

Other Number(s):: mp-1184498

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; Gd3Ho; Gd-Ho

OSTI Identifier:: 1745199

DOI:: https://doi.org/10.17188/1745199

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                    The Materials Project. Materials Data on Gd3Ho by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1745199.

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                    The Materials Project. Materials Data on Gd3Ho by Materials Project.  United States.  doi:https://doi.org/10.17188/1745199

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                    The Materials Project. 2020.  
"Materials Data on Gd3Ho by Materials Project".  United States.  doi:https://doi.org/10.17188/1745199.  https://www.osti.gov/servlets/purl/1745199. Pub date:Fri Jun 05 00:00:00 EDT 2020

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@article{osti_1745199,

  title        = {Materials Data on Gd3Ho by Materials Project},

  author       = {The Materials Project},

  abstractNote = {HoGd3 is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Ho is bonded to twelve Gd atoms to form HoGd12 cuboctahedra that share corners with four equivalent HoGd12 cuboctahedra, corners with eight equivalent GdGd8Ho4 cuboctahedra, edges with eight equivalent HoGd12 cuboctahedra, edges with sixteen equivalent GdGd8Ho4 cuboctahedra, faces with four equivalent HoGd12 cuboctahedra, and faces with fourteen GdGd8Ho4 cuboctahedra. There are four shorter (3.55 Å) and eight longer (3.56 Å) Ho–Gd bond lengths. There are two inequivalent Gd sites. In the first Gd site, Gd is bonded to four equivalent Ho and eight Gd atoms to form GdGd8Ho4 cuboctahedra that share corners with twelve equivalent GdGd8Ho4 cuboctahedra, edges with eight equivalent HoGd12 cuboctahedra, edges with sixteen GdGd8Ho4 cuboctahedra, faces with four equivalent HoGd12 cuboctahedra, and faces with fourteen GdGd8Ho4 cuboctahedra. There are four shorter (3.55 Å) and four longer (3.56 Å) Gd–Gd bond lengths. In the second Gd site, Gd is bonded to four equivalent Ho and eight equivalent Gd atoms to form GdGd8Ho4 cuboctahedra that share corners with four equivalent GdGd8Ho4 cuboctahedra, corners with eight equivalent HoGd12 cuboctahedra, edges with twenty-four GdGd8Ho4 cuboctahedra, faces with six equivalent HoGd12 cuboctahedra, and faces with twelve GdGd8Ho4 cuboctahedra.},

  doi          = {10.17188/1745199},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {6}

}

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DOI: https://doi.org/10.17188/1745199

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