Materials Data on Li(RhO2)3 by Materials Project

doi:10.17188/1716917

Title: Materials Data on Li(RhO2)3 by Materials Project

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Abstract

Li(RhO2)2RhO2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two rhodium molecules; four water molecules; and one Li(RhO2)2 sheet oriented in the (0, 0, 1) direction. In the Li(RhO2)2 sheet, there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Li–O bond lengths are 1.96 Å. In the second Li1+ site, Li1+ is bonded in a rectangular see-saw-like geometry to four equivalent O2- atoms. All Li–O bond lengths are 1.96 Å. Rh+3.67+ is bonded in a linear geometry to two O2- atoms. Both Rh–O bond lengths are 1.92 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to one Li1+, one Rh+3.67+, and one O2- atom. The O–O bond length is 1.49 Å. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Li1+, one Rh+3.67+, and one O2- atom. The O–O bond length is 1.49 Å.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1207037

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; Li(RhO2)3; Li-O-Rh

OSTI Identifier:: 1716917

DOI:: https://doi.org/10.17188/1716917

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                    The Materials Project. Materials Data on Li(RhO2)3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1716917.

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                    The Materials Project. Materials Data on Li(RhO2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1716917

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                    The Materials Project. 2019.  
"Materials Data on Li(RhO2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1716917.  https://www.osti.gov/servlets/purl/1716917. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1716917,

  title        = {Materials Data on Li(RhO2)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Li(RhO2)2RhO2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two rhodium molecules; four water molecules; and one Li(RhO2)2 sheet oriented in the (0, 0, 1) direction. In the Li(RhO2)2 sheet, there are two inequivalent Li1+ sites. In the first Li1+ site, Li1+ is bonded in a square co-planar geometry to four equivalent O2- atoms. All Li–O bond lengths are 1.96 Å. In the second Li1+ site, Li1+ is bonded in a rectangular see-saw-like geometry to four equivalent O2- atoms. All Li–O bond lengths are 1.96 Å. Rh+3.67+ is bonded in a linear geometry to two O2- atoms. Both Rh–O bond lengths are 1.92 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to one Li1+, one Rh+3.67+, and one O2- atom. The O–O bond length is 1.49 Å. In the second O2- site, O2- is bonded in a 2-coordinate geometry to one Li1+, one Rh+3.67+, and one O2- atom. The O–O bond length is 1.49 Å.},

  doi          = {10.17188/1716917},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1716917

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