First row transition metal doped B12P12 and Al12P12 nanocages as excellent single atom catalysts for the hydrogen evolution reaction
Abdulrahman Allangawi, Mazhar Amjad Gilani, Khurshid Ayub, Tariq Mahmood
Topics & Concepts
OverpotentialNanocagesCatalysisTransition metalDensity functional theoryAtom (system on chip)HydrogenGibbs free energyDopingMaterials sciencePhysical chemistryHydrogen atomMetalWater splittingChemistryNanotechnologyComputational chemistryThermodynamicsPhotocatalysisMetallurgyOrganic chemistryPhysicsAlkylElectrodeComputer scienceElectrochemistryEmbedded systemOptoelectronicsElectrocatalysts for Energy ConversionMXene and MAX Phase MaterialsBoron and Carbon Nanomaterials Research