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In this paper, we explore quantum interference in molecular conductance from the point of view of graph theory and walks on lattices. By virtue of the Cayley-Hamilton theorem for characteristic polynomials and the Coulson-Rushbrooke pairing…

Chemical Physics · Physics 2018-04-26 Yuta Tsuji , Ernesto Estrada , Ramis Movassagh , Roald Hoffmann

The realization of self-assembled molecular-electronic films, whose room-temperature transport properties are controlled by quantum interference (QI), is an essential step in the scale-up QI effects from single molecules to parallel arrays…

The electrostatic gating effects on molecular transistors are investigated using the density functional theory (DFT) combined with the nonequilibrium Green's function (NEGF) method. When molecular energy levels are away from the Fermi…

Mesoscale and Nanoscale Physics · Physics 2011-09-28 D. Hou , J. H. Wei

The transport and gain properties of quantum cascade (QC) structures are investigated using a nonequilibrium Green's function (NGF) theory which includes quantum effects beyond a Boltzmann transport description. In the NGF theory, we…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 S. -C. Lee , A. Wacker

We study the charge transport properties of triangular quantum dot molecule (TQDM) connected to metallic electrodes, taking into account all correlation functions and relevant charging states. The quantum interference (QI) effect of TQDM…

Mesoscale and Nanoscale Physics · Physics 2015-02-24 Chih-Chieh Chen , Yia-chung Chang , David M T Kuo

We present an ab initio approach to electronic transport in nanoscale systems which includes electronic correlations through the GW approximation. With respect to Landauer approaches based on density-functional theory (DFT), we introduce a…

Mesoscale and Nanoscale Physics · Physics 2010-09-08 Pierre Darancet , Andrea Ferretti , Didier Mayou , Valerio Olevano

We present a general framework for quantum interference (QI) between multiple, fundamentally different processes. Our framework reveals the importance of shaped input wavefunctions in enabling QI, and predicts unprecedented interactions…

Quantum Physics · Physics 2023-10-10 J. Lim , Y. S. Ang , L. K. Ang , L. J. Wong

Based on the self-consistent $T$-matrix approximation, the quantum interference (QI) effect is studied with the diagrammatic technique in weakly-disordered two-dimensional crystals with nearly half-filled bands. In addition to the usual…

Superconductivity · Physics 2009-11-07 Y. H. Yang , D. Y. Xing , Y. G. Wang , M. Liu

We study the temperature-dependent quantum correction to conductivity due to the interplay of spin density fluctuations and weak disorder for a two-dimensional metal near an antiferromagnetic (AFM) quantum critical point. AFM spin density…

Strongly Correlated Electrons · Physics 2016-02-16 Philipp S. Weiß , Boris N. Narozhny , Jörg Schmalian , Peter Wölfle

We analyze an interplay between the proximity effect and quantum interference of electrons in hybrid structures superconductor-normal metal-superconductor which contain several insulating barriers. We demonstrate that the dc Josephson…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Artem V. Galaktionov , Andrei D. Zaikin

We theoretically investigate transport signatures of quantum interference in highly symmetric double quantum dots in a parallel geometry and demonstrate that extremely weak symmetry-breaking effects can have a dramatic influence on the…

Mesoscale and Nanoscale Physics · Physics 2019-03-06 Zeng-Zhao Li , Martin Leijnse

We investigate multi-terminal quantum transport through single monocyclic aromatic annulene molecules, and their derivatives, using the nonequilibrium Green function approach in the self-consistent Hartree-Fock approximation. A new device…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 D. M. Cardamone , C. A. Stafford , S. Mazumdar

We analyze a model for electronic structure and interactions in twisted transition metal chalcogenide WSe$_2$ for superconductivity. In this material, spin-orbit scattering locks the z-components of spins of low-energy fermions near the…

Superconductivity · Physics 2024-10-15 A. V. Chubukov , C. M. Varma

The alignment of molecular levels with the Fermi energy in single molecule junctions is a crucial factor in determining their conductance or the observability of quantum interference effects. In the present study which is based on density…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 Robert Stadler

By carrying out density functional theory (DFT) analysis within the Keldysh non-equilibrium Green's function (NEGF) framework, we investigate the quantum transport properties of Au-C60-Au molecular junctions from the first principles. We…

Materials Science · Physics 2007-05-23 N. Sergueev , D. Roubtsov , H. Guo

A quantum effect at ambient conditions is presented. A benzene dithiol (BDT) molecule or a tetrahydrofuran (THF) molecule is used as a barrier molecule bridging the gold electrodes from a Mechanically Controllable Break junction. It has…

Mesoscale and Nanoscale Physics · Physics 2021-09-23 C. J. Muller

Quantum interference (QI) can strongly enhance thermoelectric response, with higher-order "supernodes" predicted to yield scalable gains in thermopower and efficiency. A central question, however, is whether such features are intrinsically…

Mesoscale and Nanoscale Physics · Physics 2025-10-09 Justin P. Bergfield

Bottom-up on-surface synthesis enables the fabrication of carbon nanostructures with atomic precision. Good examples are graphene nanoribbons (GNRs), 1D conjugated polymers, and nanoporous graphenes (NPGs), which are gathering increasing…

Mesoscale and Nanoscale Physics · Physics 2025-02-24 Gaetano Calogero , Isaac Alcón , Onurcan Kaya , Nick Papior , Aron W. Cummings , Mads Brandbyge , Stephan Roche

We report the first experimental study of the quantum interference correction to the conductivity of bilayer graphene. Low-field, positive magnetoconductivity due to the weak localisation effect is investigated at different carrier…

Mesoscale and Nanoscale Physics · Physics 2007-08-14 R. V. Gorbachev , F. V. Tikhonenko , A. S. Mayorov , D. W. Horsell , A. K. Savchenko

Recent observations of destructive quantum interference in single-molecule junctions confirm the role played by quantum effects in the electronic conductance properties of molecular systems. We show here that the destructive interference…

Mesoscale and Nanoscale Physics · Physics 2017-09-25 Riccardo Frisenda , Vera Jansen , Ferdinand C. Grozema , Herre S. J. van der Zant , Nicolas Renaud