A DFT analysis unravelling hydrogen sorption pathways in Laves phase Cu2Cd
Snigdha Dey, Saroj Kumari, Parag A. Deshpande
Topics & Concepts
Laves phaseAdsorptionHydrogen storageHydrogenChemistryDensity functional theoryDiffusionSorptionChemical physicsPhase (matter)Surface diffusionEnergeticsPhysical chemistryInorganic chemistryComputational chemistryThermodynamicsIntermetallicOrganic chemistryPhysicsAlloyHydrogen Storage and MaterialsCatalysts for Methane Reformingnanoparticles nucleation surface interactions