A density functional theory investigation of graphene-based materials

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2014
Sayın, Ceren Sibel
Employability of graphene-based materials in various technological applications in order to exploit its exceptional properties is achieved/improved via their interactions with various atoms, molecules, nanostructures and surfaces. In this thesis, the interaction of cyclohexane and derived molecules, carbon nanotubes and metallic surfaces with both pristine and defected graphene structures are investigated using density functional theory.

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Citation Formats
C. S. Sayın, “A density functional theory investigation of graphene-based materials,” Ph.D. - Doctoral Program, Middle East Technical University, 2014.