Ab-initio calculation of electronic and optical properties of nitrogen and boron doped graphene nanosheet

Graphene nanosheet has been doped with nitrogen, boron and nitrogen–boron pair of different concentrations. Modifications of electronic and optical properties due to nitrogen, boron and nitrogen–boron codoping in graphene nanosheet have been explored in the frame work of ab-initio density functional...

Ausführliche Beschreibung