Materials Data on CaReBi by Materials Project

doi:10.17188/1279159

Title: Materials Data on CaReBi by Materials Project

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Abstract

CaReBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca is bonded in a 4-coordinate geometry to four equivalent Re and six equivalent Bi atoms. All Ca–Re bond lengths are 2.93 Å. All Ca–Bi bond lengths are 3.38 Å. Re is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Bi atoms. All Re–Bi bond lengths are 2.93 Å. Bi is bonded in a distorted q6 geometry to six equivalent Ca and four equivalent Re atoms.

Authors:: The Materials Project

Publication Date:: Mon Jul 20 00:00:00 EDT 2020

Other Number(s):: mp-631458

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; CaReBi; Bi-Ca-Re

OSTI Identifier:: 1279159

DOI:: https://doi.org/10.17188/1279159

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                    The Materials Project. Materials Data on CaReBi by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1279159.

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                    The Materials Project. Materials Data on CaReBi by Materials Project.  United States.  doi:https://doi.org/10.17188/1279159

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                    The Materials Project. 2020.  
"Materials Data on CaReBi by Materials Project".  United States.  doi:https://doi.org/10.17188/1279159.  https://www.osti.gov/servlets/purl/1279159. Pub date:Mon Jul 20 00:00:00 EDT 2020

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@article{osti_1279159,

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

  author       = {The Materials Project},

  abstractNote = {CaReBi is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca is bonded in a 4-coordinate geometry to four equivalent Re and six equivalent Bi atoms. All Ca–Re bond lengths are 2.93 Å. All Ca–Bi bond lengths are 3.38 Å. Re is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent Bi atoms. All Re–Bi bond lengths are 2.93 Å. Bi is bonded in a distorted q6 geometry to six equivalent Ca and four equivalent Re atoms.},

  doi          = {10.17188/1279159},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon Jul 20 00:00:00 EDT 2020},

  month        = {Mon Jul 20 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1279159

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