Materials Data on Hg3F by Materials Project

doi:10.17188/1314209

Title: Materials Data on Hg3F by Materials Project

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Abstract

(Hg)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 Hg framework. In the Hg framework, there are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a 4-coordinate geometry to four equivalent Hg atoms. All Hg–Hg bond lengths are 3.04 Å. In the second Hg site, Hg is bonded in a body-centered cubic geometry to eight equivalent Hg atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-18

Other Number(s):: mp-973778

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; Hg3F; F-Hg

OSTI Identifier:: 1314209

DOI:: https://doi.org/10.17188/1314209

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                    The Materials Project. Materials Data on Hg3F by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314209.

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                    The Materials Project. Materials Data on Hg3F by Materials Project.  United States.  doi:https://doi.org/10.17188/1314209

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                    The Materials Project. 2020.  
"Materials Data on Hg3F by Materials Project".  United States.  doi:https://doi.org/10.17188/1314209.  https://www.osti.gov/servlets/purl/1314209. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1314209,

  title        = {Materials Data on Hg3F by Materials Project},

  author       = {The Materials Project},

  abstractNote = {(Hg)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 Hg framework. In the Hg framework, there are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a 4-coordinate geometry to four equivalent Hg atoms. All Hg–Hg bond lengths are 3.04 Å. In the second Hg site, Hg is bonded in a body-centered cubic geometry to eight equivalent Hg atoms.},

  doi          = {10.17188/1314209},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1314209

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