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Title: Materials Data on SrBr2O7 by Materials Project

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:
Publication Date:
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

Citation Formats

The Materials Project. Materials Data on SrBr2O7 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1718623.
The Materials Project. Materials Data on SrBr2O7 by Materials Project. United States. doi:https://doi.org/10.17188/1718623
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
@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 = {2020},
month = {5}
}