Materials Data on NdSn3Ru by Materials Project

doi:10.17188/1746942

Title: Materials Data on NdSn3Ru by Materials Project

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Abstract

NdRuSn3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded in a 12-coordinate geometry to four equivalent Ru and twelve equivalent Sn atoms. All Nd–Ru bond lengths are 3.47 Å. There are four shorter (3.42 Å) and eight longer (3.44 Å) Nd–Sn bond lengths. In the second Nd site, Nd is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms. All Nd–Sn bond lengths are 3.43 Å. Ru is bonded in a 6-coordinate geometry to three equivalent Nd and six equivalent Sn atoms. All Ru–Sn bond lengths are 2.69 Å. Sn is bonded in a 2-coordinate geometry to four Nd, two equivalent Ru, and three equivalent Sn atoms. There are one shorter (3.09 Å) and two longer (3.19 Å) Sn–Sn bond lengths.

Authors:: The Materials Project

Publication Date:: 2020-04-29

Other Number(s):: mp-1198161

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; NdSn3Ru; Nd-Ru-Sn

OSTI Identifier:: 1746942

DOI:: https://doi.org/10.17188/1746942

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                    The Materials Project. Materials Data on NdSn3Ru by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1746942.

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                    The Materials Project. Materials Data on NdSn3Ru by Materials Project.  United States.  doi:https://doi.org/10.17188/1746942

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                    The Materials Project. 2020.  
"Materials Data on NdSn3Ru by Materials Project".  United States.  doi:https://doi.org/10.17188/1746942.  https://www.osti.gov/servlets/purl/1746942. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1746942,

  title        = {Materials Data on NdSn3Ru by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NdRuSn3 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. there are two inequivalent Nd sites. In the first Nd site, Nd is bonded in a 12-coordinate geometry to four equivalent Ru and twelve equivalent Sn atoms. All Nd–Ru bond lengths are 3.47 Å. There are four shorter (3.42 Å) and eight longer (3.44 Å) Nd–Sn bond lengths. In the second Nd site, Nd is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms. All Nd–Sn bond lengths are 3.43 Å. Ru is bonded in a 6-coordinate geometry to three equivalent Nd and six equivalent Sn atoms. All Ru–Sn bond lengths are 2.69 Å. Sn is bonded in a 2-coordinate geometry to four Nd, two equivalent Ru, and three equivalent Sn atoms. There are one shorter (3.09 Å) and two longer (3.19 Å) Sn–Sn bond lengths.},

  doi          = {10.17188/1746942},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {4}

}

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DOI: https://doi.org/10.17188/1746942

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