Materials Data on SrBr2O7 by Materials Project

doi:10.17188/1718623

Title: Materials Data on SrBr2O7 by Materials Project

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Abstract

SrO7Br2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Sr is bonded in a 11-coordinate geometry to eleven O atoms. There are a spread of Sr–O bond distances ranging from 2.63–3.02 Å. There are four inequivalent O sites. In the first O site, O is bonded in a 1-coordinate geometry to two equivalent Sr and one Br atom. The O–Br bond length is 1.69 Å. In the second O site, O is bonded in a bent 120 degrees geometry to one Sr and one Br atom. The O–Br bond length is 1.69 Å. In the third O site, O is bonded in a 2-coordinate geometry to two equivalent Sr and one Br atom. The O–Br bond length is 1.69 Å. In the fourth O site, O is bonded in a single-bond geometry to one Sr atom. Br is bonded in a trigonal non-coplanar geometry to three O atoms.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-1179129

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; SrBr2O7; Br-O-Sr

OSTI Identifier:: 1718623

DOI:: https://doi.org/10.17188/1718623

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                    The Materials Project. Materials Data on SrBr2O7 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1718623.

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                    The Materials Project. Materials Data on SrBr2O7 by Materials Project.  United States.  doi:https://doi.org/10.17188/1718623

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                    The Materials Project. 2020.  
"Materials Data on SrBr2O7 by Materials Project".  United States.  doi:https://doi.org/10.17188/1718623.  https://www.osti.gov/servlets/purl/1718623. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1718623,

  title        = {Materials Data on SrBr2O7 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SrO7Br2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. Sr is bonded in a 11-coordinate geometry to eleven O atoms. There are a spread of Sr–O bond distances ranging from 2.63–3.02 Å. There are four inequivalent O sites. In the first O site, O is bonded in a 1-coordinate geometry to two equivalent Sr and one Br atom. The O–Br bond length is 1.69 Å. In the second O site, O is bonded in a bent 120 degrees geometry to one Sr and one Br atom. The O–Br bond length is 1.69 Å. In the third O site, O is bonded in a 2-coordinate geometry to two equivalent Sr and one Br atom. The O–Br bond length is 1.69 Å. In the fourth O site, O is bonded in a single-bond geometry to one Sr atom. Br is bonded in a trigonal non-coplanar geometry to three O atoms.},

  doi          = {10.17188/1718623},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1718623

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