Dynamic transformation of cubic copper catalysts during CO2 electroreduction and its impact on catalytic selectivity
To rationally design effective and stable catalysts for energy conversion applications, we
need to understand how they transform under reaction conditions and reveal their …
need to understand how they transform under reaction conditions and reveal their …
Implicit solvation methods for catalysis at electrified interfaces
Implicit solvation is an effective, highly coarse-grained approach in atomic-scale simulations
to account for a surrounding liquid electrolyte on the level of a continuous polarizable …
to account for a surrounding liquid electrolyte on the level of a continuous polarizable …