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Title: Materials Data on Cs(SeO3)2 by Materials Project

Abstract

Cs(SeO3)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Cs is bonded in a 10-coordinate geometry to ten O atoms. There are a spread of Cs–O bond distances ranging from 3.04–3.56 Å. There are two inequivalent Se sites. In the first Se site, Se is bonded in a trigonal non-coplanar geometry to three O atoms. There is one shorter (1.66 Å) and two longer (1.67 Å) Se–O bond length. In the second Se site, Se is bonded in a trigonal non-coplanar geometry to three O atoms. There is two shorter (1.66 Å) and one longer (1.67 Å) Se–O bond length. There are six inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to three equivalent Cs and one Se atom. In the second O site, O is bonded in a distorted single-bond geometry to two equivalent Cs and one Se atom. In the third O site, O is bonded in a distorted single-bond geometry to two equivalent Cs and one Se atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one Cs and one Se atom. In the fifth O site, O is bondedmore » in a distorted single-bond geometry to one Cs and one Se atom. In the sixth O site, O is bonded in a single-bond geometry to one Cs and one Se atom.« less

Publication Date:
Other Number(s):
mp-1189389
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; Cs(SeO3)2; Cs-O-Se
OSTI Identifier:
1687410
DOI:
https://doi.org/10.17188/1687410

Citation Formats

The Materials Project. Materials Data on Cs(SeO3)2 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1687410.
The Materials Project. Materials Data on Cs(SeO3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1687410
The Materials Project. 2019. "Materials Data on Cs(SeO3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1687410. https://www.osti.gov/servlets/purl/1687410. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1687410,
title = {Materials Data on Cs(SeO3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Cs(SeO3)2 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. Cs is bonded in a 10-coordinate geometry to ten O atoms. There are a spread of Cs–O bond distances ranging from 3.04–3.56 Å. There are two inequivalent Se sites. In the first Se site, Se is bonded in a trigonal non-coplanar geometry to three O atoms. There is one shorter (1.66 Å) and two longer (1.67 Å) Se–O bond length. In the second Se site, Se is bonded in a trigonal non-coplanar geometry to three O atoms. There is two shorter (1.66 Å) and one longer (1.67 Å) Se–O bond length. There are six inequivalent O sites. In the first O site, O is bonded in a distorted single-bond geometry to three equivalent Cs and one Se atom. In the second O site, O is bonded in a distorted single-bond geometry to two equivalent Cs and one Se atom. In the third O site, O is bonded in a distorted single-bond geometry to two equivalent Cs and one Se atom. In the fourth O site, O is bonded in a distorted single-bond geometry to one Cs and one Se atom. In the fifth O site, O is bonded in a distorted single-bond geometry to one Cs and one Se atom. In the sixth O site, O is bonded in a single-bond geometry to one Cs and one Se atom.},
doi = {10.17188/1687410},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}