Materials Data on Tb6Zn23 by Materials Project

doi:10.17188/1740651

Title: Materials Data on Tb6Zn23 by Materials Project

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Abstract

Tb6Zn23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to twelve Zn atoms. There are a spread of Tb–Zn bond distances ranging from 3.09–3.23 Å. There are four inequivalent Zn sites. In the first Zn site, Zn is bonded in a 12-coordinate geometry to three equivalent Tb and nine Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.61–2.83 Å. In the second Zn site, Zn is bonded in a body-centered cubic geometry to eight equivalent Zn atoms. All Zn–Zn bond lengths are 2.72 Å. In the third Zn site, Zn is bonded to four equivalent Tb and eight Zn atoms to form a mixture of corner and face-sharing ZnTb4Zn8 cuboctahedra. All Zn–Zn bond lengths are 2.78 Å. In the fourth Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Tb and seven Zn atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-04

Other Number(s):: mp-1193291

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; Tb6Zn23; Tb-Zn

OSTI Identifier:: 1740651

DOI:: https://doi.org/10.17188/1740651

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                    The Materials Project. Materials Data on Tb6Zn23 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1740651.

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                    The Materials Project. Materials Data on Tb6Zn23 by Materials Project.  United States.  doi:https://doi.org/10.17188/1740651

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                    The Materials Project. 2020.  
"Materials Data on Tb6Zn23 by Materials Project".  United States.  doi:https://doi.org/10.17188/1740651.  https://www.osti.gov/servlets/purl/1740651. Pub date:Mon May 04 00:00:00 EDT 2020

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@article{osti_1740651,

  title        = {Materials Data on Tb6Zn23 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Tb6Zn23 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Tb is bonded in a 12-coordinate geometry to twelve Zn atoms. There are a spread of Tb–Zn bond distances ranging from 3.09–3.23 Å. There are four inequivalent Zn sites. In the first Zn site, Zn is bonded in a 12-coordinate geometry to three equivalent Tb and nine Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.61–2.83 Å. In the second Zn site, Zn is bonded in a body-centered cubic geometry to eight equivalent Zn atoms. All Zn–Zn bond lengths are 2.72 Å. In the third Zn site, Zn is bonded to four equivalent Tb and eight Zn atoms to form a mixture of corner and face-sharing ZnTb4Zn8 cuboctahedra. All Zn–Zn bond lengths are 2.78 Å. In the fourth Zn site, Zn is bonded in a 10-coordinate geometry to three equivalent Tb and seven Zn atoms.},

  doi          = {10.17188/1740651},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1740651

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