Materials Data on Lu5BiPd2 by Materials Project

doi:10.17188/1744401

Title: Materials Data on Lu5BiPd2 by Materials Project

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Abstract

Lu5Pd2Bi crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded to four equivalent Pd and two equivalent Bi atoms to form distorted corner-sharing LuBi2Pd4 octahedra. The corner-sharing octahedra tilt angles range from 0–48°. All Lu–Pd bond lengths are 2.95 Å. Both Lu–Bi bond lengths are 3.43 Å. In the second Lu site, Lu is bonded in a 5-coordinate geometry to three equivalent Pd and two equivalent Bi atoms. There are one shorter (2.93 Å) and two longer (2.95 Å) Lu–Pd bond lengths. Both Lu–Bi bond lengths are 3.25 Å. Pd is bonded in a 8-coordinate geometry to eight Lu atoms. Bi is bonded in a 10-coordinate geometry to ten Lu atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1210532

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; Lu5BiPd2; Bi-Lu-Pd

OSTI Identifier:: 1744401

DOI:: https://doi.org/10.17188/1744401

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                    The Materials Project. Materials Data on Lu5BiPd2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1744401.

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                    The Materials Project. Materials Data on Lu5BiPd2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1744401

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                    The Materials Project. 2020.  
"Materials Data on Lu5BiPd2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1744401.  https://www.osti.gov/servlets/purl/1744401. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1744401,

  title        = {Materials Data on Lu5BiPd2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Lu5Pd2Bi crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded to four equivalent Pd and two equivalent Bi atoms to form distorted corner-sharing LuBi2Pd4 octahedra. The corner-sharing octahedra tilt angles range from 0–48°. All Lu–Pd bond lengths are 2.95 Å. Both Lu–Bi bond lengths are 3.43 Å. In the second Lu site, Lu is bonded in a 5-coordinate geometry to three equivalent Pd and two equivalent Bi atoms. There are one shorter (2.93 Å) and two longer (2.95 Å) Lu–Pd bond lengths. Both Lu–Bi bond lengths are 3.25 Å. Pd is bonded in a 8-coordinate geometry to eight Lu atoms. Bi is bonded in a 10-coordinate geometry to ten Lu atoms.},

  doi          = {10.17188/1744401},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1744401

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