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Title: Materials Data on CsClO3 by Materials Project

Abstract

CsO3Cl is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Cs is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Cs–O bond distances ranging from 3.20–3.42 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Cs and one Cl atom to form a mixture of distorted corner and edge-sharing OCs3Cl tetrahedra. The O–Cl bond length is 1.51 Å. In the second O site, O is bonded in a 1-coordinate geometry to three equivalent Cs and one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three O atoms.

Publication Date:
Other Number(s):
mp-779389
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; CsClO3; Cl-Cs-O
OSTI Identifier:
1306360
DOI:
10.17188/1306360

Citation Formats

The Materials Project. Materials Data on CsClO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1306360.
The Materials Project. Materials Data on CsClO3 by Materials Project. United States. doi:10.17188/1306360.
The Materials Project. 2020. "Materials Data on CsClO3 by Materials Project". United States. doi:10.17188/1306360. https://www.osti.gov/servlets/purl/1306360. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1306360,
title = {Materials Data on CsClO3 by Materials Project},
author = {The Materials Project},
abstractNote = {CsO3Cl is Potassium chlorate structured and crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Cs is bonded in a 9-coordinate geometry to nine O atoms. There are a spread of Cs–O bond distances ranging from 3.20–3.42 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Cs and one Cl atom to form a mixture of distorted corner and edge-sharing OCs3Cl tetrahedra. The O–Cl bond length is 1.51 Å. In the second O site, O is bonded in a 1-coordinate geometry to three equivalent Cs and one Cl atom. The O–Cl bond length is 1.51 Å. Cl is bonded in a trigonal non-coplanar geometry to three O atoms.},
doi = {10.17188/1306360},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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