Phys. Chem. Chem. Phys., 2015, Advance Article
DOI: 10.1039/C5CP02529J, Paper
DOI: 10.1039/C5CP02529J, Paper
Tor S. Bjorheim, Marco Arrigoni, Denis Gryaznov, Eugene Kotomin, Joachim Maier
First principles phonon calculations reveal that neutral and charged oxygen vacancies in BaZrO3 display widely different vibrational and thermodynamic properties.
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First principles phonon calculations reveal that neutral and charged oxygen vacancies in BaZrO3 display widely different vibrational and thermodynamic properties.
To cite this article before page numbers are assigned, use the DOI form of citation above.
The content of this RSS Feed (c) The Royal Society of Chemistry