Materials Data on GaReAs by Materials Project

doi:10.17188/1279260

Title: Materials Data on GaReAs by Materials Project

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Abstract

ReGaAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Re is bonded in a 10-coordinate geometry to four equivalent Ga and six equivalent As atoms. All Re–Ga bond lengths are 2.61 Å. All Re–As bond lengths are 3.01 Å. Ga is bonded in a body-centered cubic geometry to four equivalent Re and four equivalent As atoms. All Ga–As bond lengths are 2.61 Å. As is bonded to six equivalent Re and four equivalent Ga atoms to form a mixture of distorted face and corner-sharing AsGa4Re6 tetrahedra.

Authors:: The Materials Project

Publication Date:: Thu Jul 23 00:00:00 EDT 2020

Other Number(s):: mp-631572

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; GaReAs; As-Ga-Re

OSTI Identifier:: 1279260

DOI:: https://doi.org/10.17188/1279260

Citation Formats


                    The Materials Project. Materials Data on GaReAs by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1279260.

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                    The Materials Project. Materials Data on GaReAs by Materials Project.  United States.  doi:https://doi.org/10.17188/1279260

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                    The Materials Project. 2020.  
"Materials Data on GaReAs by Materials Project".  United States.  doi:https://doi.org/10.17188/1279260.  https://www.osti.gov/servlets/purl/1279260. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1279260,

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

  author       = {The Materials Project},

  abstractNote = {ReGaAs is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Re is bonded in a 10-coordinate geometry to four equivalent Ga and six equivalent As atoms. All Re–Ga bond lengths are 2.61 Å. All Re–As bond lengths are 3.01 Å. Ga is bonded in a body-centered cubic geometry to four equivalent Re and four equivalent As atoms. All Ga–As bond lengths are 2.61 Å. As is bonded to six equivalent Re and four equivalent Ga atoms to form a mixture of distorted face and corner-sharing AsGa4Re6 tetrahedra.},

  doi          = {10.17188/1279260},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 23 00:00:00 EDT 2020},

  month        = {Thu Jul 23 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1279260

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