Materials Data on Lu3(MnGa2)2 by Materials Project

doi:10.17188/1740718

Title: Materials Data on Lu3(MnGa2)2 by Materials Project

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Abstract

Lu3(MnGa2)2 crystallizes in the orthorhombic Ima2 space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. There are two shorter (2.94 Å) and two longer (2.95 Å) Lu–Mn bond lengths. There are a spread of Lu–Ga bond distances ranging from 2.86–3.15 Å. In the second Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. All Lu–Mn bond lengths are 2.93 Å. There are a spread of Lu–Ga bond distances ranging from 2.86–3.13 Å. In the third Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. There are two shorter (2.92 Å) and two longer (2.93 Å) Lu–Mn bond lengths. There are a spread of Lu–Ga bond distances ranging from 2.86–3.12 Å. Mn is bonded in a 9-coordinate geometry to six Lu and three Ga atoms. There are one shorter (2.68 Å) and two longer (2.69 Å) Mn–Ga bond lengths. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a 10-coordinate geometry to six Lu, two equivalentmore »« less

Publication Date:: 2020-05-02

Other Number(s):: mp-1222834

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Ga-Lu-Mn; Lu3(MnGa2)2; crystal structure

OSTI Identifier:: 1740718

DOI:: https://doi.org/10.17188/1740718

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                    Materials Data on Lu3(MnGa2)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1740718.

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                    Materials Data on Lu3(MnGa2)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1740718

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                    2020.  
"Materials Data on Lu3(MnGa2)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1740718.  https://www.osti.gov/servlets/purl/1740718. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1740718,

  title        = {Materials Data on Lu3(MnGa2)2 by Materials Project},

  
  abstractNote = {Lu3(MnGa2)2 crystallizes in the orthorhombic Ima2 space group. The structure is three-dimensional. there are three inequivalent Lu sites. In the first Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. There are two shorter (2.94 Å) and two longer (2.95 Å) Lu–Mn bond lengths. There are a spread of Lu–Ga bond distances ranging from 2.86–3.15 Å. In the second Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. All Lu–Mn bond lengths are 2.93 Å. There are a spread of Lu–Ga bond distances ranging from 2.86–3.13 Å. In the third Lu site, Lu is bonded in a 11-coordinate geometry to four equivalent Mn and seven Ga atoms. There are two shorter (2.92 Å) and two longer (2.93 Å) Lu–Mn bond lengths. There are a spread of Lu–Ga bond distances ranging from 2.86–3.12 Å. Mn is bonded in a 9-coordinate geometry to six Lu and three Ga atoms. There are one shorter (2.68 Å) and two longer (2.69 Å) Mn–Ga bond lengths. There are three inequivalent Ga sites. In the first Ga site, Ga is bonded in a 10-coordinate geometry to six Lu, two equivalent Mn, and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.80 Å. In the second Ga site, Ga is bonded in a 3-coordinate geometry to three Lu and six Ga atoms. There are two shorter (2.79 Å) and two longer (2.80 Å) Ga–Ga bond lengths. In the third Ga site, Ga is bonded in a 10-coordinate geometry to six Lu, two equivalent Mn, and two equivalent Ga atoms.},

  doi          = {10.17188/1740718},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1740718

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