Materials Data on Nd5Ru2 by Materials Project

doi:10.17188/1711212

Title: Materials Data on Nd5Ru2 by Materials Project

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Abstract

Nd5Ru2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Nd sites. In the first Nd site, Nd is bonded in a 2-coordinate geometry to three equivalent Ru atoms. There are a spread of Nd–Ru bond distances ranging from 2.80–3.54 Å. In the second Nd site, Nd is bonded to four equivalent Ru atoms to form distorted edge-sharing NdRu4 tetrahedra. There are two shorter (2.97 Å) and two longer (3.03 Å) Nd–Ru bond lengths. In the third Nd site, Nd is bonded in a 3-coordinate geometry to three equivalent Ru atoms. There are a spread of Nd–Ru bond distances ranging from 2.89–3.18 Å. Ru is bonded in a 7-coordinate geometry to eight Nd atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1103979

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; Nd5Ru2; Nd-Ru

OSTI Identifier:: 1711212

DOI:: https://doi.org/10.17188/1711212

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                    The Materials Project. Materials Data on Nd5Ru2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1711212.

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                    The Materials Project. Materials Data on Nd5Ru2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1711212

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                    The Materials Project. 2020.  
"Materials Data on Nd5Ru2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1711212.  https://www.osti.gov/servlets/purl/1711212. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1711212,

  title        = {Materials Data on Nd5Ru2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nd5Ru2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Nd sites. In the first Nd site, Nd is bonded in a 2-coordinate geometry to three equivalent Ru atoms. There are a spread of Nd–Ru bond distances ranging from 2.80–3.54 Å. In the second Nd site, Nd is bonded to four equivalent Ru atoms to form distorted edge-sharing NdRu4 tetrahedra. There are two shorter (2.97 Å) and two longer (3.03 Å) Nd–Ru bond lengths. In the third Nd site, Nd is bonded in a 3-coordinate geometry to three equivalent Ru atoms. There are a spread of Nd–Ru bond distances ranging from 2.89–3.18 Å. Ru is bonded in a 7-coordinate geometry to eight Nd atoms.},

  doi          = {10.17188/1711212},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1711212

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