Materials Data on Lu3Ga5Ni by Materials Project

doi:10.17188/1314302

Title: Materials Data on Lu3Ga5Ni by Materials Project

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Abstract

Lu3NiGa5 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Lu is bonded in a 5-coordinate geometry to one Ni and ten Ga atoms. The Lu–Ni bond length is 2.77 Å. There are four shorter (2.93 Å) and six longer (3.19 Å) Lu–Ga bond lengths. Ni is bonded in a 9-coordinate geometry to three equivalent Lu and six equivalent Ga atoms. All Ni–Ga bond lengths are 2.63 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded to six equivalent Lu, two equivalent Ni, and four Ga atoms to form a mixture of distorted face, edge, and corner-sharing GaLu6Ga4Ni2 cuboctahedra. There are two shorter (2.66 Å) and two longer (2.78 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 9-coordinate geometry to six equivalent Lu and three equivalent Ga atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-973878

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; Lu3Ga5Ni; Ga-Lu-Ni

OSTI Identifier:: 1314302

DOI:: https://doi.org/10.17188/1314302

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                    The Materials Project. Materials Data on Lu3Ga5Ni by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314302.

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                    The Materials Project. Materials Data on Lu3Ga5Ni by Materials Project.  United States.  doi:https://doi.org/10.17188/1314302

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                    The Materials Project. 2020.  
"Materials Data on Lu3Ga5Ni by Materials Project".  United States.  doi:https://doi.org/10.17188/1314302.  https://www.osti.gov/servlets/purl/1314302. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1314302,

  title        = {Materials Data on Lu3Ga5Ni by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Lu3NiGa5 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Lu is bonded in a 5-coordinate geometry to one Ni and ten Ga atoms. The Lu–Ni bond length is 2.77 Å. There are four shorter (2.93 Å) and six longer (3.19 Å) Lu–Ga bond lengths. Ni is bonded in a 9-coordinate geometry to three equivalent Lu and six equivalent Ga atoms. All Ni–Ga bond lengths are 2.63 Å. There are two inequivalent Ga sites. In the first Ga site, Ga is bonded to six equivalent Lu, two equivalent Ni, and four Ga atoms to form a mixture of distorted face, edge, and corner-sharing GaLu6Ga4Ni2 cuboctahedra. There are two shorter (2.66 Å) and two longer (2.78 Å) Ga–Ga bond lengths. In the second Ga site, Ga is bonded in a 9-coordinate geometry to six equivalent Lu and three equivalent Ga atoms.},

  doi          = {10.17188/1314302},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1314302

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