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We study the nature of the electronic states in the intermediate band formed by interstitial titanium in silicon. Our single-site description combines effects of electronic correlations, captured by dynamical mean-field theory, and…

Strongly Correlated Electrons · Physics 2021-11-17 A. Östlin , L. Chioncel

The counterpropagating edge states of a two-dimensional topological insulator (TI) carry electrons of opposite spins. We investigate the transport properties of edge states in a two-dimensional TI which is contacted to ferromagnetic leads.…

Mesoscale and Nanoscale Physics · Physics 2012-09-25 Yuan Li , M. B. A. Jalil , Seng Ghee Tan , GuangHui Zhou

Analytic results for the conductance of a molecular wire attached to mesoscopic tubule leads are obtained. They permit to study linear transport in presence of low dimensional leads in the whole range of parameters. In particular contact…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 G. Cuniberti , G. Fagas , K. Richter

We study the effects of electron-electron correlations and confinement potential on the far-infrared spectrum of a lateral two-electron quantum dot molecule by exact diagonalization. The calculated spectra directly reflect the lowered…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 M. Marlo , A. Harju , R. M. Nieminen

We theoretically examine the effect of the coupling of the transport electrons to a vibrational mode of the molecule on the ac linear-response conductance of molecular junctions. Representing the molecule by a single electronic state, we…

Mesoscale and Nanoscale Physics · Physics 2015-05-27 A. Ueda , O. Entin-Wohlman , A. Aharony

We investigate the influence of electron-electron interactions on the conductance of two-dimensional disordered spinless electrons. By using an efficient numerical method which is based on exact diagonalization in a truncated basis of…

Strongly Correlated Electrons · Physics 2009-10-31 Thomas Vojta , Frank Epperlein , Michael Schreiber

It is understood that molecular conjugation plays an important role in charge transport through single-molecule junctions. Here, we investigate electron transport through an anthraquinone based single-molecule three-terminal device. With…

Mesoscale and Nanoscale Physics · Physics 2016-05-19 M. Koole , J. M. Thijssen , H. Valkenier , J. C. Hummelen , H. S. J. van der Zant

A comprehensive review is presented of single molecule junction conductance measurements across families of molecules measured while breaking a gold point contact in a solution of molecules with amine end groups. A theoretical framework…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Mark S. Hybertsen , Latha Venkataraman , Jennifer E. Klare , Adam C. Whalley , Michael L. Steigerwald , Colin Nuckolls

An electron transport is studied in the system which consists of scanning tunneling microscopy-single molecule magnet-metal. Due to quantum tunneling of magnetization in single-molecule magnet, linear response conductance exhibits stepwise…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Gwang-Hee Kim , Tae-Suk Kim

Strong repulsive interactions within a one dimensional Fermi system in a two-probe configuration normally lead to a reduced off-resonance conductance. We show that if the repulsive interaction extends to the contact regions, a strong…

Strongly Correlated Electrons · Physics 2007-06-18 Dan Bohr , Peter Schmitteckert

The dependence of the transport properties on the specific location of the Fermi level in molecular electronics devices is studied by using electrodes of different materials. The zero-bias transport properties are shown to depend…

Mesoscale and Nanoscale Physics · Physics 2008-12-06 V. M. García-Suárez , C. J. Lambert

The conduction band electron states of laterally-coupled semiconductor quantum rings are studied within the frame of the effective mass envelope function theory. We consider the effect of axial and in-plane magnetic fields for several…

Mesoscale and Nanoscale Physics · Physics 2015-06-25 J. Planelles , F. Rajadell , J. I. Climente , M. Royo , J. L. Movilla

We study electron transmission through a periodic array of quantum dots (QD) sandwiched between doped semiconductor leads. When the Fermi wavelength of tunneling electron exceeds the array lattice constant, the off-resonant per QD…

Mesoscale and Nanoscale Physics · Physics 2015-05-28 L. S. Petrosyan , A. S. Kirakosyan , T. V. Shahbazyan

The interplay between the Kondo effect and the inter-dot magnetic interaction in a coupled-dot system is studied. An exact result for the transport properties at zero temperature is obtained by diagonalizing a cluster, composed by the…

Strongly Correlated Electrons · Physics 2009-10-31 C. A. Büsser , E. V. Anda , A. L Lima , Maria A. Davidovich , G. Chiappe

A double-stranded system, modeled by a Frenkel-Kontorova lattice, is studied through nonequilibrium molecular dynamics simulations. We have investigated the thermal conductance influenced by the intra-chain interaction as well as by the…

Materials Science · Physics 2015-06-03 Wei-Rong Zhong

We investigate finite temperature corrections to the Landauer formula due to electron-electron interaction within the quantum point contact. When the Fermi level is close to the barrier height, the interaction is strongly enhanced due to…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 C. Sloggett , A. I. Milstein , O. P. Sushkov

Molecular electronic devices are the upmost destiny of the miniaturization trend of electronic components. Although not yet reproducible on large scale, molecular devices are since recently subject of intense studies both experimentally and…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 G. Cuniberti , F. Grossmann , R. Gutierrez

This mini review focuses on conductance measurements through molecular junctions containing few tens of molecules, which are fabricated along two approaches: (i) conducting atomic force microscope contacting a self-assembled monolayers on…

Applied Physics · Physics 2019-11-12 Dominique Vuillaume

Coulomb interactions that occur in electronic structure calculations are correlated by allowing basis function components of the interacting densities to polarize, thereby reducing the magnitude of the interaction. Exchange integrals of…

Chemical Physics · Physics 2022-05-16 Jerry L. Whitten

We present a quaternion-inspired formalism specifically developed to evaluate the electric current that traverses a single molecule subjected to an externally applied voltage. The molecule of interest is covalently connected to two small…

Mesoscale and Nanoscale Physics · Physics 2014-08-06 Augusto C. L. Moreira , Celso P. de Melo