481 citations · 1.1k across the 9 of their papers we have counts for
9 papers
Control of thermoelectric properties of phase-coherent molecular wires
Víctor M. García-Suarez, Colin J. Lambert, David Zs. Manrique +1
We demonstrate how redox control of intra-molecular quantum interference in phase-coherent molecular wires can be used to enhance the thermopower (Seebeck coefficient) S and thermo…
A quantum circuit rule for interference effects in single-molecule electrical junctions
David Zsolt Manrique, Cancan Huang, Masoud Baghernejad +9
A quantum circuit rule for combining quantum interference (QI) effects in the conductive properties of oligo(phenyleneethynylene) (OPE)-type molecules possessing three aromatic rin…
Searching the hearts of graphene-like molecules for simplicity, sensitivity and logic
Sara Sangtarash, Cancan Huang, Hatef Sadeghi +7
If quantum interference patterns in the hearts of polycyclic aromatic hydrocarbons (PAHs) could be isolated and manipulated, then a significant step towards realizing the potential…
Magic ratios for connectivity-driven electrical conductance of graphene-like molecules
Yan Geng, Sara Sangtarash, Cancan Huang +7
Experiments using a mechanically-controlled break junction and calculations based on density functional theory demonstrate a new magic ratio rule (MRR),which captures the contribut…
Conduction mechanisms in biphenyl-dithiol single-molecule junctions
M. Bürkle, J. K. Viljas, A. Mishchenko +5
Based on density-functional theory calculations, we report a detailed study of the single-molecule charge-transport properties for a series of recently synthesized biphenyl-dithiol…
Charge Transport in Single Au|Alkanedithiol|Au Junctions: Coordination Geometries and Conformational Degrees of Freedom
Chen Li, Ilya Pobelov, Thomas Wandlowski +3
Recent STM molecular break-junction experiments have revealed multiple series of peaks in the conductance histograms of alkanedithiols. To resolve a current controversy, we present…