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Title: Materials Data on SrSeO3 by Materials Project

Abstract

SrSeO3 is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Sr2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Sr–O bond distances ranging from 2.66–3.12 Å. Se4+ is bonded in a trigonal non-coplanar geometry to three O2- atoms. There is one shorter (1.72 Å) and two longer (1.74 Å) Se–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Sr2+ and one Se4+ atom. In the second O2- site, O2- is bonded to three equivalent Sr2+ and one Se4+ atom to form a mixture of distorted edge and corner-sharing OSr3Se tetrahedra.

Publication Date:
Other Number(s):
mp-3395
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
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)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; SrSeO3; O-Se-Sr
OSTI Identifier:
1206686
DOI:
https://doi.org/10.17188/1206686

Citation Formats

The Materials Project. Materials Data on SrSeO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1206686.
The Materials Project. Materials Data on SrSeO3 by Materials Project. United States. doi:https://doi.org/10.17188/1206686
The Materials Project. 2020. "Materials Data on SrSeO3 by Materials Project". United States. doi:https://doi.org/10.17188/1206686. https://www.osti.gov/servlets/purl/1206686. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1206686,
title = {Materials Data on SrSeO3 by Materials Project},
author = {The Materials Project},
abstractNote = {SrSeO3 is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Sr2+ is bonded in a 9-coordinate geometry to nine O2- atoms. There are a spread of Sr–O bond distances ranging from 2.66–3.12 Å. Se4+ is bonded in a trigonal non-coplanar geometry to three O2- atoms. There is one shorter (1.72 Å) and two longer (1.74 Å) Se–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Sr2+ and one Se4+ atom. In the second O2- site, O2- is bonded to three equivalent Sr2+ and one Se4+ atom to form a mixture of distorted edge and corner-sharing OSr3Se tetrahedra.},
doi = {10.17188/1206686},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}