Unraveling the Negative Role of Oxygen-Vacancy Cluster in Ionic Conductivity in CeO₂: Hybrid Functional Study

Engineering & Materials Science

• Oxygen vacancies 100%
• Ionic conductivity 97%
• Cerium oxide 82%
• Vacancies 70%
• Molecular dynamics 14%
• Computer simulation 7%

Chemical Compounds

• Ionic Conductivity 60%
• Molecular Cluster 42%
• Dioxygen 15%
• Molecular Dynamics 11%
• Simulation 10%
• Energy 7%
• Application 5%

Physics & Astronomy

• ion currents 66%
• oxygen 39%
• energy of formation 8%
• tendencies 7%
• molecular dynamics 5%
• kinetics 4%
• performance 3%
• simulation 3%
• energy 2%