Materials Data on Y2Br3 by Materials Project

doi:10.17188/1741710

Title: Materials Data on Y2Br3 by Materials Project

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Abstract

Y2Br3 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Y2Br3 sheet oriented in the (2, 0, -1) direction. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 4-coordinate geometry to four Br atoms. There are two shorter (2.91 Å) and two longer (2.93 Å) Y–Br bond lengths. In the second Y site, Y is bonded in a pentagonal planar geometry to five Br atoms. There are a spread of Y–Br bond distances ranging from 2.89–3.03 Å. There are three inequivalent Br sites. In the first Br site, Br is bonded in a trigonal non-coplanar geometry to three equivalent Y atoms. In the second Br site, Br is bonded in a distorted T-shaped geometry to three Y atoms. In the third Br site, Br is bonded in a distorted T-shaped geometry to three Y atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-09

Other Number(s):: mp-1205567

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; Y2Br3; Br-Y

OSTI Identifier:: 1741710

DOI:: https://doi.org/10.17188/1741710

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                    The Materials Project. Materials Data on Y2Br3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1741710.

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                    The Materials Project. Materials Data on Y2Br3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1741710

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                    The Materials Project. 2020.  
"Materials Data on Y2Br3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1741710.  https://www.osti.gov/servlets/purl/1741710. Pub date:Sat May 09 00:00:00 EDT 2020

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@article{osti_1741710,

  title        = {Materials Data on Y2Br3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Y2Br3 crystallizes in the monoclinic C2/m space group. The structure is two-dimensional and consists of one Y2Br3 sheet oriented in the (2, 0, -1) direction. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 4-coordinate geometry to four Br atoms. There are two shorter (2.91 Å) and two longer (2.93 Å) Y–Br bond lengths. In the second Y site, Y is bonded in a pentagonal planar geometry to five Br atoms. There are a spread of Y–Br bond distances ranging from 2.89–3.03 Å. There are three inequivalent Br sites. In the first Br site, Br is bonded in a trigonal non-coplanar geometry to three equivalent Y atoms. In the second Br site, Br is bonded in a distorted T-shaped geometry to three Y atoms. In the third Br site, Br is bonded in a distorted T-shaped geometry to three Y atoms.},

  doi          = {10.17188/1741710},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1741710

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