Materials Data on AlBr3 by Materials Project

doi:10.17188/1199395

Title: Materials Data on AlBr3 by Materials Project

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Abstract

AlBr3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two al2br6 molecules. Al3+ is bonded to four Br1- atoms to form edge-sharing AlBr4 tetrahedra. There are a spread of Al–Br bond distances ranging from 2.26–2.46 Å. There are three inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one Al3+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one Al3+ atom. In the third Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Al3+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-17

Other Number(s):: mp-23288

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; AlBr3; Al-Br

OSTI Identifier:: 1199395

DOI:: https://doi.org/10.17188/1199395

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                    The Materials Project. Materials Data on AlBr3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1199395.

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                    The Materials Project. Materials Data on AlBr3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1199395

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                    The Materials Project. 2020.  
"Materials Data on AlBr3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1199395.  https://www.osti.gov/servlets/purl/1199395. Pub date:Fri Jul 17 00:00:00 EDT 2020

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@article{osti_1199395,

  title        = {Materials Data on AlBr3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {AlBr3 crystallizes in the monoclinic P2_1/c space group. The structure is zero-dimensional and consists of two al2br6 molecules. Al3+ is bonded to four Br1- atoms to form edge-sharing AlBr4 tetrahedra. There are a spread of Al–Br bond distances ranging from 2.26–2.46 Å. There are three inequivalent Br1- sites. In the first Br1- site, Br1- is bonded in a single-bond geometry to one Al3+ atom. In the second Br1- site, Br1- is bonded in a single-bond geometry to one Al3+ atom. In the third Br1- site, Br1- is bonded in an L-shaped geometry to two equivalent Al3+ atoms.},

  doi          = {10.17188/1199395},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1199395

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