Materials Data on MnAsRu by Materials Project

doi:10.17188/1680422

Title: Materials Data on MnAsRu by Materials Project

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Abstract

MnRuAs crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mn is bonded in a 4-coordinate geometry to six equivalent Ru and four As atoms. All Mn–Ru bond lengths are 2.88 Å. There are two shorter (2.35 Å) and two longer (2.46 Å) Mn–As bond lengths. Ru is bonded in a 11-coordinate geometry to six equivalent Mn and five As atoms. There are one shorter (2.46 Å) and four longer (2.68 Å) Ru–As bond lengths. There are two inequivalent As sites. In the first As site, As is bonded in a distorted trigonal planar geometry to three equivalent Mn and six equivalent Ru atoms. In the second As site, As is bonded in a 9-coordinate geometry to six equivalent Mn and three equivalent Ru atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1079969

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; MnAsRu; As-Mn-Ru

OSTI Identifier:: 1680422

DOI:: https://doi.org/10.17188/1680422

Citation Formats


                    The Materials Project. Materials Data on MnAsRu by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1680422.

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                    The Materials Project. Materials Data on MnAsRu by Materials Project.  United States.  doi:https://doi.org/10.17188/1680422

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                    The Materials Project. 2020.  
"Materials Data on MnAsRu by Materials Project".  United States.  doi:https://doi.org/10.17188/1680422.  https://www.osti.gov/servlets/purl/1680422. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1680422,

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

  author       = {The Materials Project},

  abstractNote = {MnRuAs crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Mn is bonded in a 4-coordinate geometry to six equivalent Ru and four As atoms. All Mn–Ru bond lengths are 2.88 Å. There are two shorter (2.35 Å) and two longer (2.46 Å) Mn–As bond lengths. Ru is bonded in a 11-coordinate geometry to six equivalent Mn and five As atoms. There are one shorter (2.46 Å) and four longer (2.68 Å) Ru–As bond lengths. There are two inequivalent As sites. In the first As site, As is bonded in a distorted trigonal planar geometry to three equivalent Mn and six equivalent Ru atoms. In the second As site, As is bonded in a 9-coordinate geometry to six equivalent Mn and three equivalent Ru atoms.},

  doi          = {10.17188/1680422},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1680422

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