Materials Data on KAlO3 by Materials Project

doi:10.17188/1652504

Title: Materials Data on KAlO3 by Materials Project

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Abstract

KAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. K is bonded to twelve equivalent O atoms to form KO12 cuboctahedra that share corners with twelve equivalent KO12 cuboctahedra, faces with six equivalent KO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All K–O bond lengths are 2.73 Å. Al is bonded to six equivalent O atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent KO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.93 Å. O is bonded in a distorted linear geometry to four equivalent K and two equivalent Al atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-24

Other Number(s):: mp-1184936

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; KAlO3; Al-K-O

OSTI Identifier:: 1652504

DOI:: https://doi.org/10.17188/1652504

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                    The Materials Project. Materials Data on KAlO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1652504.

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                    The Materials Project. Materials Data on KAlO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1652504

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                    The Materials Project. 2020.  
"Materials Data on KAlO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1652504.  https://www.osti.gov/servlets/purl/1652504. Pub date:Fri Jul 24 00:00:00 EDT 2020

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@article{osti_1652504,

  title        = {Materials Data on KAlO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {KAlO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. K is bonded to twelve equivalent O atoms to form KO12 cuboctahedra that share corners with twelve equivalent KO12 cuboctahedra, faces with six equivalent KO12 cuboctahedra, and faces with eight equivalent AlO6 octahedra. All K–O bond lengths are 2.73 Å. Al is bonded to six equivalent O atoms to form AlO6 octahedra that share corners with six equivalent AlO6 octahedra and faces with eight equivalent KO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Al–O bond lengths are 1.93 Å. O is bonded in a distorted linear geometry to four equivalent K and two equivalent Al atoms.},

  doi          = {10.17188/1652504},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1652504

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