Contact Information bernholcj@ornl.gov Jerzy Bernholc All Publications On-surface cyclodehydrogenation reaction pathway determined by selective molecular deuterations... Study of Anharmonicity in Zirconium Hydrides Using Inelastic Neutron Scattering and Ab-Initio Computer Modeling... Engineering Edge States of Graphene Nanoribbons for Narrow-Band Photoluminescence... Step edge-mediated assembly of periodic arrays of long graphene nanoribbons on Au(111)... Ab initio investigation of the cyclodehydrogenation process for polyanthrylene transformation to graphene nanoribbons... Direct Writing of Heterostructures In Single Atomically Precise Graphene Nanoribbons Controllable conversion of quasi-freestanding polymer chains to graphene nanoribbons... Controllable conversion of quasi-freestanding polymer chains to graphene nanoribbons Edge States and Optical Transition Energies in Carbon Nanoribbons... Recent developments and applications of the real-space multigrid method... Equivalence of dipole correction and Coulomb cutoff techniques in supercell calculations... Effects of end group functionalization and level alignment on electron transport in molecular devices...
