Materials Data on RbB2SbO6 by Materials Project

doi:10.17188/1680549

Title: Materials Data on RbB2SbO6 by Materials Project

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Abstract

RbB2SbO6 crystallizes in the orthorhombic Pmn2_1 space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.01–3.26 Å. B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.35–1.41 Å. Sb5+ is bonded to six O2- atoms to form corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 2°. There are a spread of Sb–O bond distances ranging from 1.94–2.01 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Rb1+, one B3+, and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+ and two equivalent B3+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent Sb5+ atoms. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to one Rb1+, one B3+, and one Sb5+ atom.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1209317

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; RbB2SbO6; B-O-Rb-Sb

OSTI Identifier:: 1680549

DOI:: https://doi.org/10.17188/1680549

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                    The Materials Project. Materials Data on RbB2SbO6 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1680549.

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                    The Materials Project. Materials Data on RbB2SbO6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1680549

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                    The Materials Project. 2019.  
"Materials Data on RbB2SbO6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1680549.  https://www.osti.gov/servlets/purl/1680549. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1680549,

  title        = {Materials Data on RbB2SbO6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {RbB2SbO6 crystallizes in the orthorhombic Pmn2_1 space group. The structure is three-dimensional. Rb1+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Rb–O bond distances ranging from 3.01–3.26 Å. B3+ is bonded in a trigonal planar geometry to three O2- atoms. There are a spread of B–O bond distances ranging from 1.35–1.41 Å. Sb5+ is bonded to six O2- atoms to form corner-sharing SbO6 octahedra. The corner-sharing octahedral tilt angles are 2°. There are a spread of Sb–O bond distances ranging from 1.94–2.01 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two equivalent Rb1+, one B3+, and one Sb5+ atom. In the second O2- site, O2- is bonded in a distorted bent 120 degrees geometry to two equivalent Rb1+ and two equivalent B3+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent Sb5+ atoms. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to one Rb1+, one B3+, and one Sb5+ atom.},

  doi          = {10.17188/1680549},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1680549

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