Materials Data on ErZn3 by Materials Project

doi:10.17188/1672921

Title: Materials Data on ErZn3 by Materials Project

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Abstract

ErZn3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to fourteen Zn atoms. There are a spread of Er–Zn bond distances ranging from 2.97–3.43 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to five equivalent Er and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.58–2.74 Å. In the second Zn site, Zn is bonded in a 12-coordinate geometry to five equivalent Er and seven Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.58–3.06 Å. In the third Zn site, Zn is bonded in a 10-coordinate geometry to four equivalent Er and six Zn atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1188367

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; ErZn3; Er-Zn

OSTI Identifier:: 1672921

DOI:: https://doi.org/10.17188/1672921

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                    The Materials Project. Materials Data on ErZn3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1672921.

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                    The Materials Project. Materials Data on ErZn3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1672921

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                    The Materials Project. 2020.  
"Materials Data on ErZn3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1672921.  https://www.osti.gov/servlets/purl/1672921. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1672921,

  title        = {Materials Data on ErZn3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {ErZn3 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er is bonded in a 11-coordinate geometry to fourteen Zn atoms. There are a spread of Er–Zn bond distances ranging from 2.97–3.43 Å. There are three inequivalent Zn sites. In the first Zn site, Zn is bonded in a 10-coordinate geometry to five equivalent Er and five Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.58–2.74 Å. In the second Zn site, Zn is bonded in a 12-coordinate geometry to five equivalent Er and seven Zn atoms. There are a spread of Zn–Zn bond distances ranging from 2.58–3.06 Å. In the third Zn site, Zn is bonded in a 10-coordinate geometry to four equivalent Er and six Zn atoms.},

  doi          = {10.17188/1672921},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1672921

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