Influence of surface atomic structure demonstrated on oxygen incorporation mechanism at a model perovskite oxide

Author(s)
Michele Riva, Markus Kubicek, Xianfeng Hao, Giada Franceschi, Stefan Gerhold, Michael Schmid, Herbert Hutter, Juergen Fleig, Cesare Franchini, Bilge Yildiz, Ulrike Diebold
Organisation(s)
Computational Materials Physics
Journal
Nature Communications
Volume
9
No. of pages
9
ISSN
2041-1723
DOI
https://doi.org/10.1038/s41467-018-05685-5
Publication date
09-2018
Publication status
Published
Peer reviewed
Yes
Austrian Fields of Science 2012
104011 Materials chemistry, 103018 Materials physics
Keywords
INITIO MOLECULAR-DYNAMICS, THIN-FILM, ELECTROCHEMICAL PERFORMANCE, EXCHANGE KINETICS, FUEL-CELLS, TRANSITION, CATHODE, DISSOCIATION, SEGREGATION, ORIENTATION
Portal url
https://ucris.univie.ac.at/portal/en/publications/influence-of-surface-atomic-structure-demonstrated-on-oxygen-incorporation-mechanism-at-a-model-perovskite-oxide(2e19f43a-fd76-488d-8593-41ee23e9a7cc).html