Materials Data on AlVO3 by Materials Project

doi:10.17188/1666941

Title: Materials Data on AlVO3 by Materials Project

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Abstract

AlVO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. V3+ is bonded to twelve equivalent O2- atoms to form VO12 cuboctahedra that share corners with twelve equivalent VO12 cuboctahedra, faces with six equivalent VO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All V–O bond lengths are 2.57 Å. Al3+ is bonded to six equivalent O2- atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent VO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.82 Å. O2- is bonded in a distorted linear geometry to four equivalent V3+ and two equivalent Al3+ atoms.

Authors:: The Materials Project

Publication Date:: Fri Jul 24 00:00:00 EDT 2020

Other Number(s):: mp-1183128

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; AlVO3; Al-O-V

OSTI Identifier:: 1666941

DOI:: https://doi.org/10.17188/1666941

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                    The Materials Project. Materials Data on AlVO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1666941.

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                    The Materials Project. Materials Data on AlVO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1666941

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                    The Materials Project. 2020.  
"Materials Data on AlVO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1666941.  https://www.osti.gov/servlets/purl/1666941. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1666941,

  title        = {Materials Data on AlVO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {AlVO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. V3+ is bonded to twelve equivalent O2- atoms to form VO12 cuboctahedra that share corners with twelve equivalent VO12 cuboctahedra, faces with six equivalent VO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All V–O bond lengths are 2.57 Å. Al3+ is bonded to six equivalent O2- atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent VO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.82 Å. O2- is bonded in a distorted linear geometry to four equivalent V3+ and two equivalent Al3+ atoms.},

  doi          = {10.17188/1666941},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Fri Jul 24 00:00:00 EDT 2020},

  month        = {Fri Jul 24 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1666941

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