Materials Data on TmNi5 by Materials Project

doi:10.17188/1188034

Title: Materials Data on TmNi5 by Materials Project

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Abstract

TmNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Tm 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) Tm–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Tm and nine Ni atoms. There are six shorter (2.42 Å) and three longer (2.79 Å) Ni–Ni bond lengths. In the second Ni site, Ni is bonded to four equivalent Tm and eight Ni atoms to form a mixture of corner, edge, and face-sharing NiTm4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.41 Å.

Authors:: The Materials Project

Publication Date:: 2020-07-15

Other Number(s):: mp-11526

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; TmNi5; Ni-Tm

OSTI Identifier:: 1188034

DOI:: https://doi.org/10.17188/1188034

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                    The Materials Project. Materials Data on TmNi5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1188034.

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                    The Materials Project. Materials Data on TmNi5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1188034

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                    The Materials Project. 2020.  
"Materials Data on TmNi5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1188034.  https://www.osti.gov/servlets/purl/1188034. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1188034,

  title        = {Materials Data on TmNi5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {TmNi5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Tm 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) Tm–Ni bond lengths. There are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 12-coordinate geometry to three equivalent Tm and nine Ni atoms. There are six shorter (2.42 Å) and three longer (2.79 Å) Ni–Ni bond lengths. In the second Ni site, Ni is bonded to four equivalent Tm and eight Ni atoms to form a mixture of corner, edge, and face-sharing NiTm4Ni8 cuboctahedra. All Ni–Ni bond lengths are 2.41 Å.},

  doi          = {10.17188/1188034},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1188034

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