Adsorption of molecular hydrogen on honeycomb ZnO monolayers: A quantum density-functional theory perspective

Aliezer Martinez-Mesa, Llinersy Uranga-Pinna, Nadine Halberstadt +3

We investigate the adsorption of molecular hydrogen on pristine zinc oxide (ZnO) platelets. The volumetric and gravimetric hydrogen storage capacities of the ZnO monolayers are eva…