Materials Data on CaInHg2 by Materials Project

doi:10.17188/1311857

Title: Materials Data on CaInHg2 by Materials Project

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Abstract

CaHg2In is Heusler structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Hg and six equivalent In atoms. There are two shorter (3.16 Å) and six longer (3.23 Å) Ca–Hg bond lengths. All Ca–In bond lengths are 3.71 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent In atoms. There are one shorter (3.17 Å) and three longer (3.23 Å) Hg–In bond lengths. In is bonded in a distorted body-centered cubic geometry to six equivalent Ca and eight equivalent Hg atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-21

Other Number(s):: mp-867201

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; CaInHg2; Ca-Hg-In

OSTI Identifier:: 1311857

DOI:: https://doi.org/10.17188/1311857

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                    The Materials Project. Materials Data on CaInHg2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1311857.

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                    The Materials Project. Materials Data on CaInHg2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1311857

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                    The Materials Project. 2020.  
"Materials Data on CaInHg2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1311857.  https://www.osti.gov/servlets/purl/1311857. Pub date:Tue Jul 21 00:00:00 EDT 2020

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@article{osti_1311857,

  title        = {Materials Data on CaInHg2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CaHg2In is Heusler structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Ca is bonded in a body-centered cubic geometry to eight equivalent Hg and six equivalent In atoms. There are two shorter (3.16 Å) and six longer (3.23 Å) Ca–Hg bond lengths. All Ca–In bond lengths are 3.71 Å. Hg is bonded in a body-centered cubic geometry to four equivalent Ca and four equivalent In atoms. There are one shorter (3.17 Å) and three longer (3.23 Å) Hg–In bond lengths. In is bonded in a distorted body-centered cubic geometry to six equivalent Ca and eight equivalent Hg atoms.},

  doi          = {10.17188/1311857},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1311857

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