Materials Data on SmAlGe by Materials Project

doi:10.17188/1205130

Title: Materials Data on SmAlGe by Materials Project

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Abstract

SmAlGe crystallizes in the tetragonal I4_1md space group. The structure is three-dimensional. Sm is bonded to six equivalent Al and six equivalent Ge atoms to form a mixture of edge and face-sharing SmAl6Ge6 cuboctahedra. All Sm–Al bond lengths are 3.23 Å. There are four shorter (3.22 Å) and two longer (3.26 Å) Sm–Ge bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Ge atoms. There are one shorter (2.44 Å) and two longer (2.45 Å) Al–Ge bond lengths. In the second Al site, Al is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Ge atoms. All Al–Sm bond lengths are 3.23 Å. There are one shorter (2.44 Å) and two longer (2.45 Å) Al–Ge bond lengths. Ge is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Al atoms.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-3077

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; SmAlGe; Al-Ge-Sm

OSTI Identifier:: 1205130

DOI:: https://doi.org/10.17188/1205130

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                    The Materials Project. Materials Data on SmAlGe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205130.

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                    The Materials Project. Materials Data on SmAlGe by Materials Project.  United States.  doi:https://doi.org/10.17188/1205130

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                    The Materials Project. 2020.  
"Materials Data on SmAlGe by Materials Project".  United States.  doi:https://doi.org/10.17188/1205130.  https://www.osti.gov/servlets/purl/1205130. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1205130,

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

  author       = {The Materials Project},

  abstractNote = {SmAlGe crystallizes in the tetragonal I4_1md space group. The structure is three-dimensional. Sm is bonded to six equivalent Al and six equivalent Ge atoms to form a mixture of edge and face-sharing SmAl6Ge6 cuboctahedra. All Sm–Al bond lengths are 3.23 Å. There are four shorter (3.22 Å) and two longer (3.26 Å) Sm–Ge bond lengths. There are two inequivalent Al sites. In the first Al site, Al is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Ge atoms. There are one shorter (2.44 Å) and two longer (2.45 Å) Al–Ge bond lengths. In the second Al site, Al is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Ge atoms. All Al–Sm bond lengths are 3.23 Å. There are one shorter (2.44 Å) and two longer (2.45 Å) Al–Ge bond lengths. Ge is bonded in a distorted trigonal planar geometry to six equivalent Sm and three equivalent Al atoms.},

  doi          = {10.17188/1205130},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1205130

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