Hydrogen detection on black phosphorene doped with Ni, Pd, and Pt: Periodic density functional calculations
Mehdi Ghambarian, Zahra Azizi, Mohammad Ghashghaee
Topics & Concepts
PhosphoreneDensity functional theoryMonolayerHydrogenDopingNickelMoleculeMaterials scienceAdsorptionSelectivityBand gapAtoms in moleculesChemical physicsChemistryComputational chemistryPhysical chemistryNanotechnologyOptoelectronicsOrganic chemistryCatalysisMetallurgy2D Materials and ApplicationsMXene and MAX Phase MaterialsGas Sensing Nanomaterials and Sensors