Potential and support-dependent hydrogen evolution reaction activation energies on sulfur vacancies of MoS2 from GC-DFT
Nawras Abidi, Audrey Bonduelle‐Skrzypczak, Stephan N. Steinmann
Topics & Concepts
ChemistryCatalysisTafel equationActivation energyDensity functional theorySulfurElectrochemistryHydrogenReaction rate constantThermodynamicsAdsorptionPhysical chemistryChemical physicsComputational chemistryKineticsElectrodePhysicsOrganic chemistryQuantum mechanicsElectrocatalysts for Energy ConversionChalcogenide Semiconductor Thin FilmsAdvanced Photocatalysis Techniques