Materials Data on CuRe2Cl by Materials Project

doi:10.17188/1279137

Title: Materials Data on CuRe2Cl by Materials Project

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Abstract

Re2CuCl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Re is bonded to four equivalent Cu and four equivalent Cl atoms to form a mixture of distorted edge, corner, and face-sharing ReCu4Cl4 tetrahedra. All Re–Cu bond lengths are 2.62 Å. All Re–Cl bond lengths are 2.62 Å. Cu is bonded in a 8-coordinate geometry to eight equivalent Re and six equivalent Cl atoms. All Cu–Cl bond lengths are 3.02 Å. Cl is bonded in a body-centered cubic geometry to eight equivalent Re and six equivalent Cu atoms.

Authors:: The Materials Project

Publication Date:: Fri Jul 24 00:00:00 EDT 2020

Other Number(s):: mp-631418

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; CuRe2Cl; Cl-Cu-Re

OSTI Identifier:: 1279137

DOI:: https://doi.org/10.17188/1279137

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                    The Materials Project. Materials Data on CuRe2Cl by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1279137.

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                    The Materials Project. Materials Data on CuRe2Cl by Materials Project.  United States.  doi:https://doi.org/10.17188/1279137

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                    The Materials Project. 2020.  
"Materials Data on CuRe2Cl by Materials Project".  United States.  doi:https://doi.org/10.17188/1279137.  https://www.osti.gov/servlets/purl/1279137. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1279137,

  title        = {Materials Data on CuRe2Cl by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Re2CuCl is Heusler structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Re is bonded to four equivalent Cu and four equivalent Cl atoms to form a mixture of distorted edge, corner, and face-sharing ReCu4Cl4 tetrahedra. All Re–Cu bond lengths are 2.62 Å. All Re–Cl bond lengths are 2.62 Å. Cu is bonded in a 8-coordinate geometry to eight equivalent Re and six equivalent Cl atoms. All Cu–Cl bond lengths are 3.02 Å. Cl is bonded in a body-centered cubic geometry to eight equivalent Re and six equivalent Cu atoms.},

  doi          = {10.17188/1279137},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 24 00:00:00 EDT 2020},

  month        = {Fri Jul 24 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1279137

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