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Related papers: Time-dependent quantum transport: A practical sche…

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We consider the time-dependent electron transport through a quantum dot connected to multiple leads in the presence of the additional over-dot (bridge) tunnelling channels by using the evolution operator technique. Each terminal and quantum…

Mesoscale and Nanoscale Physics · Physics 2007-06-13 R. Taranko , T. Kwapinski , E. Taranko

Simulating electron-ion dynamics using time-dependent density functional theory within an Ehrenfest dynamics scheme can be done in two ways that are in principle exact and identical: propagating time-dependent electronic Kohn-Sham equations…

Chemical Physics · Physics 2021-07-01 Lionel Lacombe , Neepa T. Maitra

Electrons in the active region of a nanostructure constitute an open many-body quantum system, interacting with contacts, phonons, and photons. We review the basic premises of the open system theory, focusing on the common approximations…

Mesoscale and Nanoscale Physics · Physics 2014-05-21 I. Knezevic , B. Novakovic

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

Transport and scattering phenomena in open quantum-systems with a continuous energy spectrum are conveniently solved using the time-dependent Schrodinger equation. In the time-dependent picture, the evolution of an initially localized…

Quantum Physics · Physics 2011-05-13 Tobias Kramer

While the vast majority of calculations reported on molecular conductance have been based on the static non-equilibrium Green's function formalism combined with density functional theory, in recent years a few time-depedent approaches to…

We present a time-linear scaling method to simulate open and correlated quantum systems out of equilibrium. The method inherits from many-body perturbation theory the possibility to choose selectively the most relevant scattering processes…

Mesoscale and Nanoscale Physics · Physics 2025-06-10 R. Tuovinen , Y. Pavlyukh , E. Perfetto , G. Stefanucci

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

We derive a time-dependent density functional theory appropriate for calculating the near-edge X-ray absorption spectrum in molecules and condensed matter. The basic assumption is to increase the space of many-body wave functions from one…

Strongly Correlated Electrons · Physics 2015-06-16 G. F. Bertsch , A. Lee

To explore whether the density-functional theory non-equilibrium Green's function formalism (DFT-NEGF) provides a rigorous framework for quantum transport, we carried out time-dependent density functional theory (TDDFT) calculations of the…

Materials Science · Physics 2011-07-01 ChiYung Yam , Xiao Zheng , GuanHua Chen , Yong Wang , Thomas Frauenheim , Thomas A. Niehaus

We generalize to the time-dependent case the stationary Internal DFT / Kohn-Sham formalism presented in Ref. [14]. We prove that, in the time-dependent case, the internal properties of a self-bound system (as an atomic nuclei) are all…

Nuclear Theory · Physics 2010-04-22 J. Messud

We present a new paradigm for the dynamical simulation of interacting many-boson open quantum systems. The method relies on a variational ansatz for the $n$-boson density matrix, in terms of a superposition of photon-added coherent states.…

Quantum Physics · Physics 2023-06-27 David S. Schlegel , Fabrizio Minganti , Vincenzo Savona

We analyze theoretically the charging current into, and the transport current through, a nanoscale two-dimensional electron system with two parallel quantum dots embedded in a short wire placed in a photon cavity. A plunger gate is used to…

Mesoscale and Nanoscale Physics · Physics 2017-05-19 Vidar Gudmundsson , Nzar Rauf Abdullah , Anna Sitek , Hsi-Sheng Goan , Chi-Shung Tang , Andrei Manolescu

For Lindblad's master equation of open quantum systems with a general quadratic form of the Hamiltonian, the propagator of the density matrix is analytically calculated by using path integral techniques. The time-dependent density matrix is…

Condensed Matter · Physics 2019-08-17 Yu. V. Palchikov , G. G. Adamian , N. V. Antonenko , W. Scheid

We present an efficient method for propagating the time-dependent Kohn-Sham equations in free space, based on the recently introduced Fourier contour deformation (FCD) approach. For potentials which are constant outside a bounded domain,…

Chemical Physics · Physics 2023-07-10 Jason Kaye , Alex Barnett , Leslie Greengard , Umberto De Giovannini , Angel Rubio

Most present applications of time-dependent density functional theory use adiabatic functionals, i.e. the effective potential at time t is determined solely by the density at the same time. This paper discusses a method that aims to go…

Strongly Correlated Electrons · Physics 2009-11-10 Yair Kurzweil , Roi Baer

A stochastic representation of the dynamics of open quantum systems, suitable for non-perturbative system-reservoir interaction, non-Markovian effects and arbitrarily driven systems is presented. It includes the case of driving on…

Statistical Mechanics · Physics 2016-10-05 Jürgen T. Stockburger

In this article, we review recent work about time dependent quantum transport through a quantum dot in Kondo regime. This represents a major step towards designing next generation transistors that are expected to replace current MOSFET's in…

Mesoscale and Nanoscale Physics · Physics 2013-03-13 Ali Goker , Elif Gedik

We studied the spin-dependent quantum transport properties using a simple modelling of a Datta-Das spin transistor. We refine previous results by accounting the propagation medium changes of opacity felt by itinerant electrons, when the…

Mesoscale and Nanoscale Physics · Physics 2015-07-10 R. Cuan , J. J. González , L. Diago-Cisneros

A closed set of coupled equations of motion for the description of time-dependent electron transport is derived. It provides the time evolution of energy-resolved quantities constructed from non-equilibrium Green functions. By means of an…

Mesoscale and Nanoscale Physics · Physics 2009-12-10 Alexander Croy , Ulf Saalmann