Materials Data on LaZn11 by Materials Project

doi:10.17188/1276132

Title: Materials Data on LaZn11 by Materials Project

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Abstract

LaZn11 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eighteen Zn atoms. There are a spread of La–Zn bond distances ranging from 3.30–3.44 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 6-coordinate geometry to two equivalent La and twelve Zn atoms. There are four shorter (2.81 Å) and eight longer (2.90 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded to two equivalent La and ten Zn atoms to form a mixture of distorted face, edge, and corner-sharing ZnLa2Zn10 cuboctahedra. There are a spread of Zn–Zn bond distances ranging from 2.61–3.00 Å. In the third Zn site, Zn is bonded in a 12-coordinate geometry to ten Zn atoms.

Authors:: The Materials Project

Publication Date:: Tue Jul 14 00:00:00 EDT 2020

Other Number(s):: mp-571191

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; LaZn11; La-Zn

OSTI Identifier:: 1276132

DOI:: https://doi.org/10.17188/1276132

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                    The Materials Project. Materials Data on LaZn11 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276132.

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                    The Materials Project. Materials Data on LaZn11 by Materials Project.  United States.  doi:https://doi.org/10.17188/1276132

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                    The Materials Project. 2020.  
"Materials Data on LaZn11 by Materials Project".  United States.  doi:https://doi.org/10.17188/1276132.  https://www.osti.gov/servlets/purl/1276132. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1276132,

  title        = {Materials Data on LaZn11 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LaZn11 crystallizes in the tetragonal I4_1/amd space group. The structure is three-dimensional. La is bonded in a 8-coordinate geometry to eighteen Zn atoms. There are a spread of La–Zn bond distances ranging from 3.30–3.44 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 6-coordinate geometry to two equivalent La and twelve Zn atoms. There are four shorter (2.81 Å) and eight longer (2.90 Å) Zn–Zn bond lengths. In the second Zn site, Zn is bonded to two equivalent La and ten Zn atoms to form a mixture of distorted face, edge, and corner-sharing ZnLa2Zn10 cuboctahedra. There are a spread of Zn–Zn bond distances ranging from 2.61–3.00 Å. In the third Zn site, Zn is bonded in a 12-coordinate geometry to ten Zn atoms.},

  doi          = {10.17188/1276132},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jul 14 00:00:00 EDT 2020},

  month        = {Tue Jul 14 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1276132

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