Materials Data on Al2O3 by Materials Project

doi:10.17188/1187823

Title: Materials Data on Al2O3 by Materials Project

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Abstract

Al2O3 is Corundum structured and crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Al3+ is bonded to six equivalent O2- atoms to form a mixture of corner, edge, and face-sharing AlO6 octahedra. The corner-sharing octahedra tilt angles range from 48–60°. There is three shorter (1.87 Å) and three longer (1.99 Å) Al–O bond length. O2- is bonded to four equivalent Al3+ atoms to form a mixture of distorted corner and edge-sharing OAl4 trigonal pyramids.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-1143

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; Al2O3; Al-O

OSTI Identifier:: 1187823

DOI:: https://doi.org/10.17188/1187823

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                    The Materials Project. Materials Data on Al2O3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187823.

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                    The Materials Project. Materials Data on Al2O3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187823

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                    The Materials Project. 2020.  
"Materials Data on Al2O3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187823.  https://www.osti.gov/servlets/purl/1187823. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1187823,

  title        = {Materials Data on Al2O3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Al2O3 is Corundum structured and crystallizes in the trigonal R-3c space group. The structure is three-dimensional. Al3+ is bonded to six equivalent O2- atoms to form a mixture of corner, edge, and face-sharing AlO6 octahedra. The corner-sharing octahedra tilt angles range from 48–60°. There is three shorter (1.87 Å) and three longer (1.99 Å) Al–O bond length. O2- is bonded to four equivalent Al3+ atoms to form a mixture of distorted corner and edge-sharing OAl4 trigonal pyramids.},

  doi          = {10.17188/1187823},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1187823

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