Materials Data on Si3Ru by Materials Project

doi:10.17188/1315928

Title: Materials Data on Si3Ru by Materials Project

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Abstract

RuSi3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ru4+ is bonded in a distorted body-centered cubic geometry to fourteen Si+1.33- atoms. There are eight shorter (2.61 Å) and six longer (3.01 Å) Ru–Si bond lengths. There are two inequivalent Si+1.33- sites. In the first Si+1.33- site, Si+1.33- is bonded in a distorted body-centered cubic geometry to four equivalent Ru4+ and four equivalent Si+1.33- atoms. All Si–Si bond lengths are 2.61 Å. In the second Si+1.33- site, Si+1.33- is bonded in a 8-coordinate geometry to six equivalent Ru4+ and eight equivalent Si+1.33- atoms.

Authors:: The Materials Project

Publication Date:: Mon Jul 20 00:00:00 EDT 2020

Other Number(s):: mp-978509

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; Si3Ru; Ru-Si

OSTI Identifier:: 1315928

DOI:: https://doi.org/10.17188/1315928

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                    The Materials Project. Materials Data on Si3Ru by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1315928.

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                    The Materials Project. Materials Data on Si3Ru by Materials Project.  United States.  doi:https://doi.org/10.17188/1315928

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                    The Materials Project. 2020.  
"Materials Data on Si3Ru by Materials Project".  United States.  doi:https://doi.org/10.17188/1315928.  https://www.osti.gov/servlets/purl/1315928. Pub date:Mon Jul 20 00:00:00 EDT 2020

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@article{osti_1315928,

  title        = {Materials Data on Si3Ru by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RuSi3 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Ru4+ is bonded in a distorted body-centered cubic geometry to fourteen Si+1.33- atoms. There are eight shorter (2.61 Å) and six longer (3.01 Å) Ru–Si bond lengths. There are two inequivalent Si+1.33- sites. In the first Si+1.33- site, Si+1.33- is bonded in a distorted body-centered cubic geometry to four equivalent Ru4+ and four equivalent Si+1.33- atoms. All Si–Si bond lengths are 2.61 Å. In the second Si+1.33- site, Si+1.33- is bonded in a 8-coordinate geometry to six equivalent Ru4+ and eight equivalent Si+1.33- atoms.},

  doi          = {10.17188/1315928},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Mon Jul 20 00:00:00 EDT 2020},

  month        = {Mon Jul 20 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1315928

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