Effects of paramagnetic fluctuations on the thermochemistry of MnO(100) surfaces in the oxygen evolution reaction

Keyphrases

• (100) Surfaces 100%
• Oxygen Evolution Reaction 100%
• Thermochemistry 100%
• Charge Transfer 66%
• Chemical Bond 66%
• Chemical Reaction 33%
• Physical Properties 33%
• Reaction Pathway 33%
• Structure-free 33%
• Valence Band 33%
• Oxide Surfaces 33%
• Electronic Structure 33%
• Sampling Methods 33%
• Free Energy 33%
• Mn Ions 33%
• Paramagnetic State 33%
• Resting State 33%
• Rate-determining Step 33%
• Antiferromagnetic Phase 33%
• Non-collinear 33%
• Free Charge 33%
• Reaction Intermediates 33%
• Correlated Oxides 33%
• Reaction Energy Barrier 33%
• Bond Enhancement 33%

Chemistry

• Thermochemistry 100%
• Chemical Bond 66%
• Electronic State 33%
• Valence Band 33%
• Antiferromagnetic 33%
• Energy Barrier 33%
• Rate-Determining Step 33%
• Reaction Intermediate 33%
• Free Energy 33%
• Sampling 33%