Materials Data on La3Yb by Materials Project

doi:10.17188/1651460

Title: Materials Data on La3Yb by Materials Project

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Abstract

YbLa3 is Copper-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Yb is bonded to twelve La atoms to form YbLa12 cuboctahedra that share corners with four equivalent YbLa12 cuboctahedra, corners with eight equivalent LaLa8Yb4 cuboctahedra, edges with eight equivalent YbLa12 cuboctahedra, edges with sixteen equivalent LaLa8Yb4 cuboctahedra, faces with four equivalent YbLa12 cuboctahedra, and faces with fourteen LaLa8Yb4 cuboctahedra. There are four shorter (3.74 Å) and eight longer (3.75 Å) Yb–La bond lengths. There are two inequivalent La sites. In the first La site, La is bonded to four equivalent Yb and eight La atoms to form LaLa8Yb4 cuboctahedra that share corners with twelve equivalent LaLa8Yb4 cuboctahedra, edges with eight equivalent YbLa12 cuboctahedra, edges with sixteen LaLa8Yb4 cuboctahedra, faces with four equivalent YbLa12 cuboctahedra, and faces with fourteen LaLa8Yb4 cuboctahedra. There are four shorter (3.74 Å) and four longer (3.75 Å) La–La bond lengths. In the second La site, La is bonded to four equivalent Yb and eight equivalent La atoms to form LaLa8Yb4 cuboctahedra that share corners with four equivalent LaLa8Yb4 cuboctahedra, corners with eight equivalent YbLa12 cuboctahedra, edges with twenty-four LaLa8Yb4 cuboctahedra, faces with six equivalent YbLa12 cuboctahedra, and faces with twelvemore » LaLa8Yb4 cuboctahedra.« less

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1185118

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; La3Yb; La-Yb

OSTI Identifier:: 1651460

DOI:: https://doi.org/10.17188/1651460

Citation Formats


                    The Materials Project. Materials Data on La3Yb by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1651460.

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                    The Materials Project. Materials Data on La3Yb by Materials Project.  United States.  doi:https://doi.org/10.17188/1651460

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                    The Materials Project. 2020.  
"Materials Data on La3Yb by Materials Project".  United States.  doi:https://doi.org/10.17188/1651460.  https://www.osti.gov/servlets/purl/1651460. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1651460,

  title        = {Materials Data on La3Yb by Materials Project},

  author       = {The Materials Project},

  abstractNote = {YbLa3 is Copper-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Yb is bonded to twelve La atoms to form YbLa12 cuboctahedra that share corners with four equivalent YbLa12 cuboctahedra, corners with eight equivalent LaLa8Yb4 cuboctahedra, edges with eight equivalent YbLa12 cuboctahedra, edges with sixteen equivalent LaLa8Yb4 cuboctahedra, faces with four equivalent YbLa12 cuboctahedra, and faces with fourteen LaLa8Yb4 cuboctahedra. There are four shorter (3.74 Å) and eight longer (3.75 Å) Yb–La bond lengths. There are two inequivalent La sites. In the first La site, La is bonded to four equivalent Yb and eight La atoms to form LaLa8Yb4 cuboctahedra that share corners with twelve equivalent LaLa8Yb4 cuboctahedra, edges with eight equivalent YbLa12 cuboctahedra, edges with sixteen LaLa8Yb4 cuboctahedra, faces with four equivalent YbLa12 cuboctahedra, and faces with fourteen LaLa8Yb4 cuboctahedra. There are four shorter (3.74 Å) and four longer (3.75 Å) La–La bond lengths. In the second La site, La is bonded to four equivalent Yb and eight equivalent La atoms to form LaLa8Yb4 cuboctahedra that share corners with four equivalent LaLa8Yb4 cuboctahedra, corners with eight equivalent YbLa12 cuboctahedra, edges with twenty-four LaLa8Yb4 cuboctahedra, faces with six equivalent YbLa12 cuboctahedra, and faces with twelve LaLa8Yb4 cuboctahedra.},

  doi          = {10.17188/1651460},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1651460

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