Materials Data on Ce3Sn13Ru4 by Materials Project

doi:10.17188/1663953

Title: Materials Data on Ce3Sn13Ru4 by Materials Project

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Abstract

Ce3Ru4Sn13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Ru and twelve equivalent Sn atoms. All Ce–Ru bond lengths are 3.46 Å. There are four shorter (3.43 Å) and eight longer (3.46 Å) Ce–Sn bond lengths. Ru is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Sn atoms. All Ru–Sn bond lengths are 2.67 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to three equivalent Ce, two equivalent Ru, and one Sn atom. The Sn–Sn bond length is 3.33 Å. In the second Sn site, Sn is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-1198582

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; Ce3Sn13Ru4; Ce-Ru-Sn

OSTI Identifier:: 1663953

DOI:: https://doi.org/10.17188/1663953

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                    The Materials Project. Materials Data on Ce3Sn13Ru4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1663953.

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                    The Materials Project. Materials Data on Ce3Sn13Ru4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1663953

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                    The Materials Project. 2020.  
"Materials Data on Ce3Sn13Ru4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1663953.  https://www.osti.gov/servlets/purl/1663953. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1663953,

  title        = {Materials Data on Ce3Sn13Ru4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ce3Ru4Sn13 crystallizes in the cubic Pm-3n space group. The structure is three-dimensional. Ce is bonded in a 12-coordinate geometry to four equivalent Ru and twelve equivalent Sn atoms. All Ce–Ru bond lengths are 3.46 Å. There are four shorter (3.43 Å) and eight longer (3.46 Å) Ce–Sn bond lengths. Ru is bonded in a 6-coordinate geometry to three equivalent Ce and six equivalent Sn atoms. All Ru–Sn bond lengths are 2.67 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 2-coordinate geometry to three equivalent Ce, two equivalent Ru, and one Sn atom. The Sn–Sn bond length is 3.33 Å. In the second Sn site, Sn is bonded in a cuboctahedral geometry to twelve equivalent Sn atoms.},

  doi          = {10.17188/1663953},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1663953

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