Materials Data on Th2Br5 by Materials Project

doi:10.17188/1696248

Title: Materials Data on Th2Br5 by Materials Project

Dataset

Abstract

Th2Br5 crystallizes in the cubic Im-3m space group. The structure is three-dimensional and consists of two Th2Br5 frameworks. Th is bonded to five Br atoms to form corner-sharing ThBr5 square pyramids. There are four shorter (2.93 Å) and one longer (3.05 Å) Th–Br bond lengths. There are two inequivalent Br sites. In the first Br site, Br is bonded in a linear geometry to two equivalent Th atoms. In the second Br site, Br is bonded in an L-shaped geometry to two equivalent Th atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-02

Other Number(s):: mp-1191061

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; Th2Br5; Br-Th

OSTI Identifier:: 1696248

DOI:: https://doi.org/10.17188/1696248

Citation Formats


                    The Materials Project. Materials Data on Th2Br5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1696248.

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                    The Materials Project. Materials Data on Th2Br5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1696248

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                    The Materials Project. 2020.  
"Materials Data on Th2Br5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1696248.  https://www.osti.gov/servlets/purl/1696248. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1696248,

  title        = {Materials Data on Th2Br5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Th2Br5 crystallizes in the cubic Im-3m space group. The structure is three-dimensional and consists of two Th2Br5 frameworks. Th is bonded to five Br atoms to form corner-sharing ThBr5 square pyramids. There are four shorter (2.93 Å) and one longer (3.05 Å) Th–Br bond lengths. There are two inequivalent Br sites. In the first Br site, Br is bonded in a linear geometry to two equivalent Th atoms. In the second Br site, Br is bonded in an L-shaped geometry to two equivalent Th atoms.},

  doi          = {10.17188/1696248},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1696248

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