Materials Data on SnHg3 by Materials Project

doi:10.17188/1758584

Title: Materials Data on SnHg3 by Materials Project

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Abstract

Hg3Sn crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a 12-coordinate geometry to eight Hg and four equivalent Sn atoms. There are a spread of Hg–Hg bond distances ranging from 3.26–3.44 Å. There are a spread of Hg–Sn bond distances ranging from 3.28–3.42 Å. In the second Hg site, Hg is bonded in a 12-coordinate geometry to eight equivalent Hg and four equivalent Sn atoms. There are two shorter (3.28 Å) and two longer (3.41 Å) Hg–Sn bond lengths. Sn is bonded to twelve Hg atoms to form a mixture of face and corner-sharing SnHg12 cuboctahedra.

Authors:: The Materials Project

Publication Date:: 2020-09-03

Other Number(s):: mp-1187088

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; SnHg3; Hg-Sn

OSTI Identifier:: 1758584

DOI:: https://doi.org/10.17188/1758584

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                    The Materials Project. Materials Data on SnHg3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1758584.

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                    The Materials Project. Materials Data on SnHg3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1758584

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                    The Materials Project. 2020.  
"Materials Data on SnHg3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1758584.  https://www.osti.gov/servlets/purl/1758584. Pub date:Thu Sep 03 00:00:00 EDT 2020

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@article{osti_1758584,

  title        = {Materials Data on SnHg3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Hg3Sn crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. there are two inequivalent Hg sites. In the first Hg site, Hg is bonded in a 12-coordinate geometry to eight Hg and four equivalent Sn atoms. There are a spread of Hg–Hg bond distances ranging from 3.26–3.44 Å. There are a spread of Hg–Sn bond distances ranging from 3.28–3.42 Å. In the second Hg site, Hg is bonded in a 12-coordinate geometry to eight equivalent Hg and four equivalent Sn atoms. There are two shorter (3.28 Å) and two longer (3.41 Å) Hg–Sn bond lengths. Sn is bonded to twelve Hg atoms to form a mixture of face and corner-sharing SnHg12 cuboctahedra.},

  doi          = {10.17188/1758584},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {9}

}

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DOI: https://doi.org/10.17188/1758584

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