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We propose a time-dependent many-body approach to study the short-time dynamics of correlated electrons in quantum transport through nanoscale systems contacted to metallic leads. This approach is based on the time-propagation of the…

Mesoscale and Nanoscale Physics · Physics 2011-11-28 Petri Myohanen , Adrian Stan , Gianluca Stefanucci , Robert van Leeuwen

We have developed a method based on the embedded Kadanoff-Baym equations to study the time evolution of open and inhomogeneous systems. The equation of motion for the Green's function on the Keldysh contour is solved using different…

Mesoscale and Nanoscale Physics · Physics 2011-11-28 Petri Myöhänen , Adrian Stan , Gianluca Stefanucci , Robert van Leeuwen

The effects of long-range interactions in quantum transport are still largely unexplored, mainly due to the difficulty of devising efficient embedding schemes. In this work we present a substantial progress in the interacting resonant level…

Mesoscale and Nanoscale Physics · Physics 2011-10-25 E. Perfetto , G. Stefanucci , M. Cini

We study time-dependent quantum transport in a correlated model system by means of time-propagation of the Kadanoff-Baym equations for the nonequilibrium many-body Green function. We consider an initially contacted equilibrium system of a…

Mesoscale and Nanoscale Physics · Physics 2011-11-28 Petri Myöhänen , Adrian Stan , Gianluca Stefanucci , Robert van Leeuwen

We study transport through an interacting model system consisting of a central correlated site coupled to finite bandwidth tight-binding leads, which are considered as effectively noninteracting. Its nonequilibrium properties are determined…

Mesoscale and Nanoscale Physics · Physics 2011-06-29 A. -M. Uimonen , E. Khosravi , G. Stefanucci , S. Kurth , R. van Leeuwen , E. K. U. Gross

The multilayer multiconfiguration time-dependent Hartree theory within second quantization representation of the Fock space is applied to study correlated electron transport in models of single-molecule junctions. Extending previous work,…

Mesoscale and Nanoscale Physics · Physics 2015-06-12 Haobin Wang , Michael Thoss

The interaction with time-dependent external fields, especially the interplay between time-dependent driving and quantum correlations, changes the familiar picture of electron transport through nanoscale systems. Although the exact solution…

Mesoscale and Nanoscale Physics · Physics 2020-02-13 Thomas D. Honeychurch , Daniel S. Kosov

The multilayer multiconfiguration time-dependent Hartree (ML-MCTDH) theory within second quantization representation of the Fock space, a novel numerically exact methodology to treat many-body quantum dynamics for systems containing…

Mesoscale and Nanoscale Physics · Physics 2012-01-05 Haobin Wang , Ivan Pshenichnyuk , Rainer Härtle , Michael Thoss

The characteristics of molecular electronic devices are critically determined by metal-organic interfaces, which influence the arrangement of the orbital levels that participate in charge transport. Studies on self-assembled monolayers…

We consider a quantum dot, affected by a local vibrational mode and contacted to macroscopic leads, in the non-equilibrium steady-state regime. We apply a variational Lang-Firsov transformation and solve the equations of motion of the Green…

Strongly Correlated Electrons · Physics 2015-05-28 T. Koch , J. Loos , A. Alvermann , H. Fehske

The effects of the propagation of particles which have a finite life-time and an according width in their mass spectrum are discussed in the context of transport descriptions. In the first part the coupling of soft photon modes to a source…

Nuclear Theory · Physics 2017-08-23 Yu. B. Ivanov , J. Knoll , H. Van Hees , D. N. Voskresensky

We present quantum electron transport theory that incorporates dynamical effects of motion of atoms on electrode-molecule interfaces in the calculations of the electric current. The theory is based on non-equilibrium Green's functions. We…

Mesoscale and Nanoscale Physics · Physics 2018-08-14 Vincent F. Kershaw , Daniel S. Kosov

The finite-temperature transport properties of the spinless interacting fermion model coupled to non-interacting leads are investigated. Employing the unrestricted time-dependent Hartree-Fock (HF) approximation, the transmission probability…

Mesoscale and Nanoscale Physics · Physics 2015-11-05 Christian Schiegg , Michael Dzierzawa , Ulrich Eckern

We investigate magnetic-field influenced time-dependent transport of Coulomb interacting electrons through a two-dimensional quantum ring in an electromagnetic cavity under non-equilibrium conditions described by a time-convolutionless…

Mesoscale and Nanoscale Physics · Physics 2013-07-02 Thorsten Arnold , Chi-Shung Tang , Andrei Manolescu , Vidar Gudmundsson

The influence of an electron-vibrational coupling on the laser control of electron transport through a molecular wire that is attached to several electronic leads is investigated. These molecular vibrational modes induce an effective…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Jörg Lehmann , Sigmund Kohler , Volkhard May , Peter Hänggi

The generalized Kadanoff-Baym ansatz (GKBA) offers a computationally inexpensive approach to simulate out-of-equilibrium quantum systems within the framework of nonequilibrium Green's functions. For finite systems the limitation of…

Mesoscale and Nanoscale Physics · Physics 2021-03-02 Riku Tuovinen , Robert van Leeuwen , Enrico Perfetto , Gianluca Stefanucci

We theoretically investigate the transport properties of a molecule embedded in one arm of a mesoscopic Aharonov-Bohm interferometer. Due to the presence of phonons the molecule level position ($\epsilon_d$) and the electron-electron…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 Jong Soo Lim , Rosa Lopez , Gloria Platero , Pascal Simon

We present a time-dependent study of electron transport through a strongly correlated quantum dot. The time-dependent current is obtained with the multiple-probe battery method, while adiabatic lattice density functional theory in the Bethe…

Mesoscale and Nanoscale Physics · Physics 2013-02-06 A. Pertsova , M. Stamenova , S. Sanvito

We use a non-Markovian master equation to describe the transport of Coulomb interacting electrons through an electromagnetic cavity with one quantized photon mode. The central system is a finite parabolic quantum wire that is coupled weakly…

Mesoscale and Nanoscale Physics · Physics 2012-03-15 Vidar Gudmundsson , Olafur Jonasson , Chi-Shung Tang , Hsi-Sheng Goan , Andrei Manolescu

We present a theory of molecular motors based on the Ehrenfest dynamics for the nuclear coordinates and the adiabatic limit of the Kadanoff-Baym equations for the current-induced forces. Electron-electron interactions can be systematically…

Mesoscale and Nanoscale Physics · Physics 2018-07-25 Miroslav Hopjan , Gianluca Stefanucci , Enrico Perfetto , Claudio Verdozzi
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