Materials Data on Si3F by Materials Project

doi:10.17188/1313914

Title: Materials Data on Si3F by Materials Project

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Abstract

(Si)6F2 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four hydrofluoric acid molecules and one Si framework. In the Si framework, there are two inequivalent Si sites. In the first Si site, Si is bonded in a 4-coordinate geometry to four equivalent Si atoms. All Si–Si bond lengths are 2.59 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-21

Other Number(s):: mp-972767

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; Si3F; F-Si

OSTI Identifier:: 1313914

DOI:: https://doi.org/10.17188/1313914

Citation Formats


                    The Materials Project. Materials Data on Si3F by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1313914.

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                    The Materials Project. Materials Data on Si3F by Materials Project.  United States.  doi:https://doi.org/10.17188/1313914

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                    The Materials Project. 2020.  
"Materials Data on Si3F by Materials Project".  United States.  doi:https://doi.org/10.17188/1313914.  https://www.osti.gov/servlets/purl/1313914. Pub date:Tue Jul 21 00:00:00 EDT 2020

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@article{osti_1313914,

  title        = {Materials Data on Si3F by Materials Project},

  author       = {The Materials Project},

  abstractNote = {(Si)6F2 is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional and consists of four hydrofluoric acid molecules and one Si framework. In the Si framework, there are two inequivalent Si sites. In the first Si site, Si is bonded in a 4-coordinate geometry to four equivalent Si atoms. All Si–Si bond lengths are 2.59 Å. In the second Si site, Si is bonded in a body-centered cubic geometry to eight equivalent Si atoms.},

  doi          = {10.17188/1313914},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1313914

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