Materials Data on Sr2UInO6 by Materials Project

doi:10.17188/1744025

Title: Materials Data on Sr2UInO6 by Materials Project

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Abstract

Sr2UInO6 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 UO6 octahedra, and faces with four equivalent InO6 octahedra. All Sr–O bond lengths are 3.02 Å. U5+ is bonded to six equivalent O2- atoms to form UO6 octahedra that share corners with six equivalent InO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All U–O bond lengths are 2.13 Å. In3+ is bonded to six equivalent O2- atoms to form InO6 octahedra that share corners with six equivalent UO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All In–O bond lengths are 2.15 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one U5+, and one In3+ atom.

Authors:: The Materials Project

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

Other Number(s):: mp-1206007

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; Sr2UInO6; In-O-Sr-U

OSTI Identifier:: 1744025

DOI:: https://doi.org/10.17188/1744025

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                    The Materials Project. Materials Data on Sr2UInO6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1744025.

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                    The Materials Project. Materials Data on Sr2UInO6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1744025

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                    The Materials Project. 2020.  
"Materials Data on Sr2UInO6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1744025.  https://www.osti.gov/servlets/purl/1744025. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1744025,

  title        = {Materials Data on Sr2UInO6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sr2UInO6 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 UO6 octahedra, and faces with four equivalent InO6 octahedra. All Sr–O bond lengths are 3.02 Å. U5+ is bonded to six equivalent O2- atoms to form UO6 octahedra that share corners with six equivalent InO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All U–O bond lengths are 2.13 Å. In3+ is bonded to six equivalent O2- atoms to form InO6 octahedra that share corners with six equivalent UO6 octahedra and faces with eight equivalent SrO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All In–O bond lengths are 2.15 Å. O2- is bonded in a distorted linear geometry to four equivalent Sr2+, one U5+, and one In3+ atom.},

  doi          = {10.17188/1744025},

  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/10.17188/1744025

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