Materials Data on LuZnSn2 by Materials Project

doi:10.17188/1705486

Title: Materials Data on LuZnSn2 by Materials Project

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Abstract

LuZnSn2 is Parent of FeAs superconductors-derived structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Lu is bonded to four equivalent Zn and eight Sn atoms to form a mixture of edge, corner, and face-sharing LuZn4Sn8 cuboctahedra. All Lu–Zn bond lengths are 3.26 Å. There are four shorter (3.12 Å) and four longer (3.25 Å) Lu–Sn bond lengths. Zn is bonded in a 12-coordinate geometry to four equivalent Lu, four equivalent Zn, and four equivalent Sn atoms. All Zn–Zn bond lengths are 3.06 Å. All Zn–Sn bond lengths are 2.85 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 8-coordinate geometry to four equivalent Lu and four equivalent Sn atoms. All Sn–Sn bond lengths are 3.06 Å. In the second Sn site, Sn is bonded in a 8-coordinate geometry to four equivalent Lu and four equivalent Zn atoms.

Authors:: The Materials Project

Publication Date:: 2020-04-26

Other Number(s):: mp-1079133

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; LuZnSn2; Lu-Sn-Zn

OSTI Identifier:: 1705486

DOI:: https://doi.org/10.17188/1705486

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                    The Materials Project. Materials Data on LuZnSn2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1705486.

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                    The Materials Project. Materials Data on LuZnSn2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1705486

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                    The Materials Project. 2020.  
"Materials Data on LuZnSn2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1705486.  https://www.osti.gov/servlets/purl/1705486. Pub date:Sun Apr 26 00:00:00 EDT 2020

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@article{osti_1705486,

  title        = {Materials Data on LuZnSn2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LuZnSn2 is Parent of FeAs superconductors-derived structured and crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Lu is bonded to four equivalent Zn and eight Sn atoms to form a mixture of edge, corner, and face-sharing LuZn4Sn8 cuboctahedra. All Lu–Zn bond lengths are 3.26 Å. There are four shorter (3.12 Å) and four longer (3.25 Å) Lu–Sn bond lengths. Zn is bonded in a 12-coordinate geometry to four equivalent Lu, four equivalent Zn, and four equivalent Sn atoms. All Zn–Zn bond lengths are 3.06 Å. All Zn–Sn bond lengths are 2.85 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 8-coordinate geometry to four equivalent Lu and four equivalent Sn atoms. All Sn–Sn bond lengths are 3.06 Å. In the second Sn site, Sn is bonded in a 8-coordinate geometry to four equivalent Lu and four equivalent Zn atoms.},

  doi          = {10.17188/1705486},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1705486

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