Materials Data on ErNi5 by Materials Project

doi:10.17188/1309006

Title: Materials Data on ErNi5 by Materials Project

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Abstract

ErNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Er is bonded in a distorted hexagonal planar geometry to eighteen Ni atoms. There are six shorter (2.79 Å) and twelve longer (3.12 Å) Er–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to four equivalent Er and eight Ni atoms to form a mixture of edge, face, and corner-sharing NiEr4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.42 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Er and nine Ni atoms. All Ni–Ni bond lengths are 2.79 Å.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-853

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; ErNi5; Er-Ni

OSTI Identifier:: 1309006

DOI:: https://doi.org/10.17188/1309006

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                    The Materials Project. Materials Data on ErNi5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1309006.

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                    The Materials Project. Materials Data on ErNi5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1309006

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                    The Materials Project. 2020.  
"Materials Data on ErNi5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1309006.  https://www.osti.gov/servlets/purl/1309006. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1309006,

  title        = {Materials Data on ErNi5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {ErNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Er is bonded in a distorted hexagonal planar geometry to eighteen Ni atoms. There are six shorter (2.79 Å) and twelve longer (3.12 Å) Er–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded to four equivalent Er and eight Ni atoms to form a mixture of edge, face, and corner-sharing NiEr4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.42 Å. In the second Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Er and nine Ni atoms. All Ni–Ni bond lengths are 2.79 Å.},

  doi          = {10.17188/1309006},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1309006

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