Materials Data on Ce7Ru3 by Materials Project

doi:10.17188/1205471

Title: Materials Data on Ce7Ru3 by Materials Project

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Abstract

Ce7Ru3 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are three inequivalent Ce sites. In the first Ce site, Ce is bonded in a distorted water-like geometry to four equivalent Ru atoms. There are two shorter (2.83 Å) and two longer (3.42 Å) Ce–Ru bond lengths. In the second Ce site, Ce is bonded in a 3-coordinate geometry to four equivalent Ru atoms. There are a spread of Ce–Ru bond distances ranging from 2.70–3.40 Å. In the third Ce site, Ce is bonded in a 3-coordinate geometry to three equivalent Ru atoms. All Ce–Ru bond lengths are 2.97 Å. Ru is bonded in a 6-coordinate geometry to nine Ce atoms.

Authors:: The Materials Project

Publication Date:: 2020-06-24

Other Number(s):: mp-31164

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; Ce7Ru3; Ce-Ru

OSTI Identifier:: 1205471

DOI:: https://doi.org/10.17188/1205471

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                    The Materials Project. Materials Data on Ce7Ru3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1205471.

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                    The Materials Project. Materials Data on Ce7Ru3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1205471

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                    The Materials Project. 2020.  
"Materials Data on Ce7Ru3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1205471.  https://www.osti.gov/servlets/purl/1205471. Pub date:Wed Jun 24 00:00:00 EDT 2020

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@article{osti_1205471,

  title        = {Materials Data on Ce7Ru3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Ce7Ru3 crystallizes in the hexagonal P6_3mc space group. The structure is three-dimensional. there are three inequivalent Ce sites. In the first Ce site, Ce is bonded in a distorted water-like geometry to four equivalent Ru atoms. There are two shorter (2.83 Å) and two longer (3.42 Å) Ce–Ru bond lengths. In the second Ce site, Ce is bonded in a 3-coordinate geometry to four equivalent Ru atoms. There are a spread of Ce–Ru bond distances ranging from 2.70–3.40 Å. In the third Ce site, Ce is bonded in a 3-coordinate geometry to three equivalent Ru atoms. All Ce–Ru bond lengths are 2.97 Å. Ru is bonded in a 6-coordinate geometry to nine Ce atoms.},

  doi          = {10.17188/1205471},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {6}

}

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DOI: https://doi.org/10.17188/1205471

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