Issue 35, 2012
From the journal:

Chemical Communications

Octahedrality versus tetrahedrality in stoichiometric ceria nanoparticles

Annapaola Migani,†a   Konstantin M. Neyman*ab  and  Stefan T. Bromley*ab  

* Corresponding authors

a Departament de Química Física and IQTC, Universitat de Barcelona, 08028 Barcelona, Spain
E-mail: s.bromley@ub.edu, konstantin.neyman@icrea.es
Fax: +34-934021231
Tel: +34-934039266

b Institució Catalana de Recerca i Estudis Avançats (ICREA), 08010 Barcelona, Spain

Abstract

We predict that tetrahedral CenO2n nanoparticles <2 nm in size become more stable than those experimentally observed at larger sizes with truncated octahedral morphologies, based on global optimisation and density functional calculations.

Graphical abstract: Octahedrality versus tetrahedrality in stoichiometric ceria nanoparticles

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Article information

DOI
https://doi.org/10.1039/C2CC18046D
Article type
Communication
Submitted
23 Dec 2011
Accepted
07 Mar 2012
First published
07 Mar 2012

Chem. Commun., 2012,48, 4199-4201

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Octahedrality versus tetrahedrality in stoichiometric ceria nanoparticles

A. Migani, K. M. Neyman and S. T. Bromley, Chem. Commun., 2012, 48, 4199 DOI: 10.1039/C2CC18046D

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