Materials Data on BaEu3 by Materials Project

doi:10.17188/1708055

Title: Materials Data on BaEu3 by Materials Project

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Abstract

BaEu3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba is bonded in a distorted body-centered cubic geometry to fourteen Eu atoms. There are eight shorter (3.98 Å) and six longer (4.60 Å) Ba–Eu bond lengths. There are two inequivalent Eu sites. In the first Eu site, Eu is bonded in a distorted body-centered cubic geometry to four equivalent Ba and four equivalent Eu atoms. All Eu–Eu bond lengths are 3.98 Å. In the second Eu site, Eu is bonded in a 8-coordinate geometry to six equivalent Ba and eight equivalent Eu atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1183367

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; BaEu3; Ba-Eu

OSTI Identifier:: 1708055

DOI:: https://doi.org/10.17188/1708055

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                    The Materials Project. Materials Data on BaEu3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1708055.

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                    The Materials Project. Materials Data on BaEu3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1708055

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                    The Materials Project. 2020.  
"Materials Data on BaEu3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1708055.  https://www.osti.gov/servlets/purl/1708055. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1708055,

  title        = {Materials Data on BaEu3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {BaEu3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ba is bonded in a distorted body-centered cubic geometry to fourteen Eu atoms. There are eight shorter (3.98 Å) and six longer (4.60 Å) Ba–Eu bond lengths. There are two inequivalent Eu sites. In the first Eu site, Eu is bonded in a distorted body-centered cubic geometry to four equivalent Ba and four equivalent Eu atoms. All Eu–Eu bond lengths are 3.98 Å. In the second Eu site, Eu is bonded in a 8-coordinate geometry to six equivalent Ba and eight equivalent Eu atoms.},

  doi          = {10.17188/1708055},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1708055

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