Improving hydrogen evolution catalytic activity of 2D carbon allotrope biphenylene with B, N, P doping: Density functional theory investigations
Mukesh Singh, Alok Shukla, Brahmananda Chakraborty
Topics & Concepts
BiphenyleneOverpotentialGibbs free energyHydrogenChemistryCatalysisPhysical chemistryMaterials scienceDensity functional theoryCrystallographyComputational chemistryThermodynamicsOrganic chemistryPhysicsElectrodePhenylenePolymerElectrochemistryElectrocatalysts for Energy ConversionHydrogen Storage and MaterialsFuel Cells and Related Materials