Materials Data on GaFe by Materials Project

doi:10.17188/1722054

Title: Materials Data on GaFe by Materials Project

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Abstract

FeGa crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Fe is bonded to six equivalent Fe and six equivalent Ga atoms to form FeGa6Fe6 cuboctahedra that share corners with eighteen equivalent FeGa6Fe6 cuboctahedra, edges with six equivalent FeGa6Fe6 cuboctahedra, edges with twelve equivalent GaGa6Fe6 cuboctahedra, faces with eight equivalent FeGa6Fe6 cuboctahedra, and faces with twelve equivalent GaGa6Fe6 cuboctahedra. All Fe–Fe bond lengths are 2.75 Å. All Fe–Ga bond lengths are 2.57 Å. Ga is bonded to six equivalent Fe and six equivalent Ga atoms to form GaGa6Fe6 cuboctahedra that share corners with eighteen equivalent GaGa6Fe6 cuboctahedra, edges with six equivalent GaGa6Fe6 cuboctahedra, edges with twelve equivalent FeGa6Fe6 cuboctahedra, faces with eight equivalent GaGa6Fe6 cuboctahedra, and faces with twelve equivalent FeGa6Fe6 cuboctahedra. All Ga–Ga bond lengths are 2.75 Å.

Publication Date:: 2020-05-02

Other Number(s):: mp-1224926

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; Fe-Ga; GaFe; crystal structure

OSTI Identifier:: 1722054

DOI:: https://doi.org/10.17188/1722054

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                    Materials Data on GaFe by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722054.

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                    Materials Data on GaFe by Materials Project.  United States.  doi:https://doi.org/10.17188/1722054

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                    2020.  
"Materials Data on GaFe by Materials Project".  United States.  doi:https://doi.org/10.17188/1722054.  https://www.osti.gov/servlets/purl/1722054. Pub date:Sat May 02 04:00:00 UTC 2020

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@article{osti_1722054,

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

  
  abstractNote = {FeGa crystallizes in the hexagonal P-6m2 space group. The structure is three-dimensional. Fe is bonded to six equivalent Fe and six equivalent Ga atoms to form FeGa6Fe6 cuboctahedra that share corners with eighteen equivalent FeGa6Fe6 cuboctahedra, edges with six equivalent FeGa6Fe6 cuboctahedra, edges with twelve equivalent GaGa6Fe6 cuboctahedra, faces with eight equivalent FeGa6Fe6 cuboctahedra, and faces with twelve equivalent GaGa6Fe6 cuboctahedra. All Fe–Fe bond lengths are 2.75 Å. All Fe–Ga bond lengths are 2.57 Å. Ga is bonded to six equivalent Fe and six equivalent Ga atoms to form GaGa6Fe6 cuboctahedra that share corners with eighteen equivalent GaGa6Fe6 cuboctahedra, edges with six equivalent GaGa6Fe6 cuboctahedra, edges with twelve equivalent FeGa6Fe6 cuboctahedra, faces with eight equivalent GaGa6Fe6 cuboctahedra, and faces with twelve equivalent FeGa6Fe6 cuboctahedra. All Ga–Ga bond lengths are 2.75 Å.},

  doi          = {10.17188/1722054},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1722054

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