Phys. Chem. Chem. Phys., 2015, 17,20765-20774
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.
The content of this RSS Feed (c) The Royal Society of Chemistry
First principles phonon calculations reveal that neutral and charged oxygen vacancies in BaZrO3 display widely different vibrational and thermodynamic properties.
The content of this RSS Feed (c) The Royal Society of Chemistry