Materials Data on CrRhO3 by Materials Project

doi:10.17188/1722169

Title: Materials Data on CrRhO3 by Materials Project

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Abstract

CrRhO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cr3+ is bonded to twelve equivalent O2- atoms to form CrO12 cuboctahedra that share corners with twelve equivalent CrO12 cuboctahedra, faces with six equivalent CrO12 cuboctahedra, and faces with eight equivalent RhO6 octahedra. All Cr–O bond lengths are 2.77 Å. Rh3+ is bonded to six equivalent O2- atoms to form RhO6 octahedra that share corners with six equivalent RhO6 octahedra and faces with eight equivalent CrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Rh–O bond lengths are 1.96 Å. O2- is bonded in a distorted linear geometry to four equivalent Cr3+ and two equivalent Rh3+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-05

Other Number(s):: mp-1183719

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; CrRhO3; Cr-O-Rh

OSTI Identifier:: 1722169

DOI:: https://doi.org/10.17188/1722169

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                    The Materials Project. Materials Data on CrRhO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722169.

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                    The Materials Project. Materials Data on CrRhO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1722169

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                    The Materials Project. 2020.  
"Materials Data on CrRhO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1722169.  https://www.osti.gov/servlets/purl/1722169. Pub date:Tue May 05 00:00:00 EDT 2020

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@article{osti_1722169,

  title        = {Materials Data on CrRhO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CrRhO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cr3+ is bonded to twelve equivalent O2- atoms to form CrO12 cuboctahedra that share corners with twelve equivalent CrO12 cuboctahedra, faces with six equivalent CrO12 cuboctahedra, and faces with eight equivalent RhO6 octahedra. All Cr–O bond lengths are 2.77 Å. Rh3+ is bonded to six equivalent O2- atoms to form RhO6 octahedra that share corners with six equivalent RhO6 octahedra and faces with eight equivalent CrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Rh–O bond lengths are 1.96 Å. O2- is bonded in a distorted linear geometry to four equivalent Cr3+ and two equivalent Rh3+ atoms.},

  doi          = {10.17188/1722169},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1722169

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