Materials Data on Hg3Cl4O by Materials Project

doi:10.17188/1199435

Title: Materials Data on Hg3Cl4O by Materials Project

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Abstract

Hg3OCl4 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to one O2- and three Cl1- atoms. The Hg–O bond length is 2.10 Å. There are a spread of Hg–Cl bond distances ranging from 2.34–3.15 Å. O2- is bonded in a trigonal planar geometry to three equivalent Hg2+ atoms. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Hg2+ atom. In the second Cl1- site, Cl1- is bonded in a 6-coordinate geometry to six equivalent Hg2+ atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-23333

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; Hg3Cl4O; Cl-Hg-O

OSTI Identifier:: 1199435

DOI:: https://doi.org/10.17188/1199435

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                    The Materials Project. Materials Data on Hg3Cl4O by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199435.

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                    The Materials Project. Materials Data on Hg3Cl4O by Materials Project.  United States.  doi:https://doi.org/10.17188/1199435

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                    The Materials Project. 2020.  
"Materials Data on Hg3Cl4O by Materials Project".  United States.  doi:https://doi.org/10.17188/1199435.  https://www.osti.gov/servlets/purl/1199435. Pub date:Mon Jul 20 00:00:00 EDT 2020

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@article{osti_1199435,

  title        = {Materials Data on Hg3Cl4O by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Hg3OCl4 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Hg2+ is bonded in a 2-coordinate geometry to one O2- and three Cl1- atoms. The Hg–O bond length is 2.10 Å. There are a spread of Hg–Cl bond distances ranging from 2.34–3.15 Å. O2- is bonded in a trigonal planar geometry to three equivalent Hg2+ atoms. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a distorted single-bond geometry to one Hg2+ atom. In the second Cl1- site, Cl1- is bonded in a 6-coordinate geometry to six equivalent Hg2+ atoms.},

  doi          = {10.17188/1199435},

  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/10.17188/1199435

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