Materials Data on Sr2LaCrO6 by Materials Project

doi:10.17188/1662556

Title: Materials Data on Sr2LaCrO6 by Materials Project

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Abstract

Sr2CrLaO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sr2+ is bonded to twelve equivalent O2- atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, faces with four equivalent LaO6 octahedra, and faces with four equivalent CrO6 octahedra. All Sr–O bond lengths are 2.98 Å. La3+ is bonded to six equivalent O2- atoms to form LaO6 octahedra that share corners with six equivalent CrO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All La–O bond lengths are 2.31 Å. Cr5+ is bonded to six equivalent O2- atoms to form CrO6 octahedra that share corners with six equivalent LaO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cr–O bond lengths are 1.89 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one La3+, and one Cr5+ atom.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1079391

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; Sr2LaCrO6; Cr-La-O-Sr

OSTI Identifier:: 1662556

DOI:: https://doi.org/10.17188/1662556

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                    The Materials Project. Materials Data on Sr2LaCrO6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1662556.

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                    The Materials Project. Materials Data on Sr2LaCrO6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1662556

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                    The Materials Project. 2020.  
"Materials Data on Sr2LaCrO6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1662556.  https://www.osti.gov/servlets/purl/1662556. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1662556,

  title        = {Materials Data on Sr2LaCrO6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sr2CrLaO6 is (Cubic) Perovskite-derived structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Sr2+ is bonded to twelve equivalent O2- atoms to form SrO12 cuboctahedra that share corners with twelve equivalent SrO12 cuboctahedra, faces with six equivalent SrO12 cuboctahedra, faces with four equivalent LaO6 octahedra, and faces with four equivalent CrO6 octahedra. All Sr–O bond lengths are 2.98 Å. La3+ is bonded to six equivalent O2- atoms to form LaO6 octahedra that share corners with six equivalent CrO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All La–O bond lengths are 2.31 Å. Cr5+ is bonded to six equivalent O2- atoms to form CrO6 octahedra that share corners with six equivalent LaO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Cr–O bond lengths are 1.89 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one La3+, and one Cr5+ atom.},

  doi          = {10.17188/1662556},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1662556

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