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Physical Chemistry Chemical Physics

High quality research in physical chemistry, chemical physics and biophysical chemistry.

Paper

Use of site symmetry in supercell models of defective crystals: polarons in CeO2

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Corresponding authors
a
Department of Chemistry, St. Petersburg State University, St. Petersburg, Russia
b
Department of Theoretical Physics and Computer Modelling, Institute of Solid State Physics, University of Latvia, Riga, Latvia
E-mail: gryaznov@cfi.lu.lv
c
Department of Physical Chemistry of Solids, Max Planck Institute for Solid State Research, Stuttgart, Germany
Phys. Chem. Chem. Phys., 2017,19, 8340-8348

DOI: 10.1039/C6CP08582B
Received 16 Dec 2016, Accepted 10 Feb 2017
First published online 10 Feb 2017
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