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Protonation states in a cobalt-oxide catalyst for water oxidation: fine comparison of ab initio molecular dynamics and X-ray absorption spectroscopy results

Corresponding authors
Istituto di Struttura della Materia (ISM) del Consiglio Nazionale delle Ricerche, Via Salaria Km 29.5, CP 10, 00016 Monterotondo Stazione, Italy
Dept. of Physics, “Sapienza” Università di Roma, P. le A. Moro 2, 00185 Roma, Italy
Dept. of Physics, Freie Universität Berlin, Arnimallee 14, 14195 Berlin, Germany
Dipartimento di Chimica, Ingegneria Chimica e Materiali, Università de L'Aquila, Località Campo di Pile, 67100 L'Aquila, Italy
Phys. Chem. Chem. Phys., 2011,13, 15437-15441

DOI: 10.1039/C1CP21776C
Received 01 Jun 2011, Accepted 14 Jul 2011
First published online 01 Aug 2011
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