Materials Data on HgSBr by Materials Project

doi:10.17188/1753261

Title: Materials Data on HgSBr by Materials Project

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Abstract

HgSBr crystallizes in the monoclinic P2_1/m space group. The structure is one-dimensional and consists of one HgSBr ribbon oriented in the (0, 1, 0) direction. Hg2+ is bonded in a distorted rectangular see-saw-like geometry to one S1- and three equivalent Br1- atoms. The Hg–S bond length is 2.36 Å. There are one shorter (2.50 Å) and two longer (3.36 Å) Hg–Br bond lengths. S1- is bonded in a distorted single-bond geometry to one Hg2+ atom. Br1- is bonded in a 1-coordinate geometry to three equivalent Hg2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1072320

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; HgSBr; Br-Hg-S

OSTI Identifier:: 1753261

DOI:: https://doi.org/10.17188/1753261

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                    The Materials Project. Materials Data on HgSBr by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1753261.

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                    The Materials Project. Materials Data on HgSBr by Materials Project.  United States.  doi:https://doi.org/10.17188/1753261

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                    The Materials Project. 2020.  
"Materials Data on HgSBr by Materials Project".  United States.  doi:https://doi.org/10.17188/1753261.  https://www.osti.gov/servlets/purl/1753261. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1753261,

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

  author       = {The Materials Project},

  abstractNote = {HgSBr crystallizes in the monoclinic P2_1/m space group. The structure is one-dimensional and consists of one HgSBr ribbon oriented in the (0, 1, 0) direction. Hg2+ is bonded in a distorted rectangular see-saw-like geometry to one S1- and three equivalent Br1- atoms. The Hg–S bond length is 2.36 Å. There are one shorter (2.50 Å) and two longer (3.36 Å) Hg–Br bond lengths. S1- is bonded in a distorted single-bond geometry to one Hg2+ atom. Br1- is bonded in a 1-coordinate geometry to three equivalent Hg2+ atoms.},

  doi          = {10.17188/1753261},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1753261

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