Materials Data on RbHgO3 by Materials Project

doi:10.17188/1731906

Title: Materials Data on RbHgO3 by Materials Project

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Abstract

RbHgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent HgO6 octahedra. All Rb–O bond lengths are 3.10 Å. Hg is bonded to six equivalent O atoms to form HgO6 octahedra that share corners with six equivalent HgO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Hg–O bond lengths are 2.19 Å. O is bonded to four equivalent Rb and two equivalent Hg atoms to form a mixture of distorted edge, face, and corner-sharing ORb4Hg2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mp-1186886

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; RbHgO3; Hg-O-Rb

OSTI Identifier:: 1731906

DOI:: https://doi.org/10.17188/1731906

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                    The Materials Project. Materials Data on RbHgO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1731906.

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                    The Materials Project. Materials Data on RbHgO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1731906

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                    The Materials Project. 2020.  
"Materials Data on RbHgO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1731906.  https://www.osti.gov/servlets/purl/1731906. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1731906,

  title        = {Materials Data on RbHgO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RbHgO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Rb is bonded to twelve equivalent O atoms to form RbO12 cuboctahedra that share corners with twelve equivalent RbO12 cuboctahedra, faces with six equivalent RbO12 cuboctahedra, and faces with eight equivalent HgO6 octahedra. All Rb–O bond lengths are 3.10 Å. Hg is bonded to six equivalent O atoms to form HgO6 octahedra that share corners with six equivalent HgO6 octahedra and faces with eight equivalent RbO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Hg–O bond lengths are 2.19 Å. O is bonded to four equivalent Rb and two equivalent Hg atoms to form a mixture of distorted edge, face, and corner-sharing ORb4Hg2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°.},

  doi          = {10.17188/1731906},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1731906

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