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List of Abbreviations
List of Tables and Graphs
9 other sections not shown
ab-initio basal plane basis functions basis set benzene bias voltage binding energy Binnig bond length bond length alternation calculations carbon atoms Chem Chemistry computations constant coronene correlation crystal orbitals crystal structure crystallographic desorption diffraction patterns dispersion interactions electric field electron density electron diffraction electronic structure experimental Fermi level Figure fitting parameters fractional coordinates Gaussian Hartree-Fock hexagonal crystal system hexagonal graphite hexagonal unit cell image of HOPG images of graphite intensity kcal/mole lattice vector layer Lett linear molecular molecules n-n interactions number of carbon obtained ODR signal orthorhombic graphite orthorhombic supercell orthorhombic unit cell PAHs Phys polarizability polarization polycyclic aromatic hydrocarbons powder XRD pyrolytic graphite quinoid structure radiation respectively rhombohedral rhombohedral graphite sample holder Scanning Tunneling Microscopy Schematic representation simulated STM images single crystal structure of graphite supercell supermolecule Table technique temp2 temp3 total energy tunneling current unit cell wavefunctions XRD patterns Zeinalipour-Yazdi