Tuning the energy gap of graphene quantum dots functionalized by OH and COOH radicals: First principle study
Miguel Ojeda‐Martínez, Arturo Nascir Pérez Martínez, Jawad El Hamdaoui, Maykel Courel, E. Feddi, Saravana Prakash Thirumuruganandham, María Luisa Ojeda Martínez, J.L. Cuevas, C. Velásquez-Ordoñez, D. J. Mowbray
Topics & Concepts
GrapheneRadicalBand gapQuantum dotDensity functional theoryMaterials scienceElectronic structureFermi levelDipolePhotochemistryComputational chemistryChemistryMolecular physicsChemical physicsNanotechnologyElectronOptoelectronicsPhysicsOrganic chemistryQuantum mechanicsGraphene research and applicationsCarbon and Quantum Dots ApplicationsGraphene and Nanomaterials Applications