Non-equilibrium steady state conductivity in cyclo[18]carbon and its boron nitride analogue
Alexandra E. Raeber, David A. Mazziotti
Abstract
for both in-the-plane and in-the-ring conduction. The computed conductance per molecular orbital provides insight into how the orbitals-their energies and densities-drive the conduction.
Topics & Concepts
Boron nitrideConductivityCarbon fibersBoronMaterials scienceMoleculeNitrideRing (chemistry)Carbon nitrideNanotechnologyChemistryPhysical chemistryComposite materialOrganic chemistryComposite numberCatalysisPhotocatalysisLayer (electronics)Molecular Junctions and NanostructuresGraphene research and applicationsOrganic Electronics and Photovoltaics