This is a hands-on course file for “Catalyst” classes using Materials Square.
The curriculum is designed for use in Catalytic materials courses utilizing DFT simulations.
It consists of 5 educational content modules:
[Lab.1] Surface Structures/ Surface Energies
[Lab.2] Electronic Structure depend on number of layers
[Lab.3] Oxygen Reduction Reaction
[Lab.4] CO2 Reduction Reaction
[Lab.5] Nitrogen Reduction Reaction
Download Lab.5 (Week 5) Material:
MatSQ_for_class_Catalyst-W5.pdf (8.7 MB)