Materials Data on Hg2MoO4 by Materials Project

doi:10.17188/1273602

Title: Materials Data on Hg2MoO4 by Materials Project

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Abstract

Hg2MoO4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Mo4+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Mo–O bond distances ranging from 1.77–2.32 Å. Hg2+ is bonded in a 1-coordinate geometry to three O2- atoms. There are one shorter (2.20 Å) and two longer (2.65 Å) Hg–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Mo4+ and two equivalent Hg2+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Mo4+ and one Hg2+ atom.

Publication Date:: 2017-05-11

Other Number(s):: mp-566907

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; Hg-Mo-O; Hg2MoO4; crystal structure

OSTI Identifier:: 1273602

DOI:: https://doi.org/10.17188/1273602

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                    Materials Data on Hg2MoO4 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1273602.

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                    Materials Data on Hg2MoO4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1273602

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                    2017.  
"Materials Data on Hg2MoO4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1273602.  https://www.osti.gov/servlets/purl/1273602. Pub date:Thu May 11 04:00:00 UTC 2017

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@article{osti_1273602,

  title        = {Materials Data on Hg2MoO4 by Materials Project},

  
  abstractNote = {Hg2MoO4 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Mo4+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Mo–O bond distances ranging from 1.77–2.32 Å. Hg2+ is bonded in a 1-coordinate geometry to three O2- atoms. There are one shorter (2.20 Å) and two longer (2.65 Å) Hg–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Mo4+ and two equivalent Hg2+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Mo4+ and one Hg2+ atom.},

  doi          = {10.17188/1273602},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2017},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1273602

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