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The description of the dynamics of correlated electrons in quantum impurity models is typically described within the nonequilibrium Green function formalism combined with a suitable approximation. One common approach is based on the…

Strongly Correlated Electrons · Physics 2013-06-26 Tal J. Levy , Eran Rabani

Diagrammatic analysis for normal state of Hubbard model proposed in our previous paper [1] is generalized and used to investigate superconducting state of this model. We use the notion of charge quantum number to describe the irreducible…

Strongly Correlated Electrons · Physics 2010-01-20 V. A. Moskalenko , L. A. Dohotaru , D. F. Digor , I. D. Cebotari

Quantum transport through single molecules is very sensitive to the strength of the molecule-electrode contact. When a molecular junction weakly coupled to external electrodes, charging effects do play an important role (Coulomb blockade…

Mesoscale and Nanoscale Physics · Physics 2007-10-03 Bo Song

We apply a computationally efficient approach to study the time- and energy-resolved spectral properties of a two-site Hubbard model using the nonequilibrium Green's function formalism. By employing the iterative generalized Kadanoff-Baym…

Strongly Correlated Electrons · Physics 2025-06-04 Yaroslav Pavlyukh , Riku Tuovinen

{\it Ab initio} computational methods for electronic transport in nanoscaled systems are an invaluable tool for the design of quantum devices. We have developed a flexible and efficient algorithm for evaluating $I$-$V$ characteristics of…

Mesoscale and Nanoscale Physics · Physics 2016-08-16 A. R. Rocha , V. M. García-Suárez , S. Bailey , C. Lambert , J. Ferrer , S. Sanvito

We develop a model describing long-range atom-atom interactions in a two-dimensional periodic or a-periodic lattice of optical centers considering spectral and spatial broadening effects. Using both analytical and numerical Green's function…

Optics · Physics 2025-04-15 Trevor Kling , Dong-yeop Na , Mahdi Hosseini

In this article, we present a concise and self-contained introduction to nonequilibrium statistical mechanics with quantum field theory by considering an ensemble of interacting identical bosons or fermions as an example. Readers are…

Statistical Mechanics · Physics 2014-11-20 Takafumi Kita

Density functional theory (DFT) combined with non-equilibrium Greens functions (NEGF) is a powerful approach to model quantum transport under external bias potentials, at reasonable computational cost. In this work we present a new…

Materials Science · Physics 2024-07-23 Christian S. Ahart , Sergey Chulkov , Clotilde S. Cucinotta

We introduce a quantum dot orbital tight-binding non-equilibrium Green's function approach for the simulation of novel solar cell devices where both absorption and conduction are mediated by quantum dot states. By the use of basis states…

Mesoscale and Nanoscale Physics · Physics 2012-06-14 U. Aeberhard

Nonequilibrium Green's functions represent underutilized means of studying the time evolution of quantum many-body systems. In view of a rising computer power, an effort is underway to apply the Green's functions formalism to the dynamics…

Nuclear Theory · Physics 2008-11-26 Arnau Rios , Pawel Danielewicz

Electron dynamics in a two-sites Hubbard model is studied using the nonequilibrium Green's function approach. The study is motivated by the empirical observation that a full solution of the integro-differential Kadanoff-Baym equation (KBE)…

Strongly Correlated Electrons · Physics 2024-01-23 Yaroslav Pavlyukh

Following a proposal by Aronov and Ioselevich, we express the Green functions (GF) of a noninteracting disordered Fermi system as a functional integral on a real time/frequency lattice. The normalizing denominator of this functional…

Condensed Matter · Physics 2007-05-23 W. Weller , F. Stefani , M. Souleiman

Correlated classical and quantum many-particle systems out of equilibrium are of high interest in many fields, including dense plasmas, correlated solids, and ultracold atoms. Accurate theoretical description of these systems is challenging…

Statistical Mechanics · Physics 2026-04-02 Erik Schroedter , Michael Bonitz

Near equilibrium, Green-Kubo relations provide microscopic expressions for macroscopic transport coefficients in terms of equilibrium correlation functions. At their core, they are based on the intimate relationship between response and…

Statistical Mechanics · Physics 2021-12-16 Hyun-Myung Chun , Qi Gao , Jordan M. Horowitz

We propose a simple scheme that describes accurately essential non-equilibrium effects in nanoscale electronics devices using equilibrium transport theory. The scheme, which is based on the alignment and dealignment of the junction…

Mesoscale and Nanoscale Physics · Physics 2012-10-01 V. M. García-Suárez , J. Ferrer

Non-equilibrium Green's functions provide an efficient way to describe the evolution of the energy-momentum tensor during the early time pre-equilibrium stage of high-energy heavy ion collisions. Besides their practical relevance they also…

High Energy Physics - Phenomenology · Physics 2020-09-09 Syo Kamata , Mauricio Martinez , Philip Plaschke , Stephan Ochsenfeld , S. Schlichting

Molecules in molecular junctions are subject to current-induced forces that can break chemical bonds, induce reactions, destabilize molecular geometry, and halt the operation of the junction. Theories behind current-driven molecular…

Mesoscale and Nanoscale Physics · Physics 2023-01-04 Riley J. Preston , Thomas D. Honeychurch , Daniel S. Kosov

We present consistent results for molecular conduction using two central-complementary approaches: the non-equilibrium Green's function technique and the quantum master equation method. Our model describes electronic conduction in a…

Mesoscale and Nanoscale Physics · Physics 2016-04-13 Bijay Kumar Agarwalla , Dvira Segal

We generalize the methods used in the theory of correlation dynamics and establish a set of equations of motion for many-body correlation green's functions in the non-relativistic case. These non-linear and coupled equations of motion…

Nuclear Theory · Physics 2015-06-26 Shun-Jin Wang , Wei Zuo , Wolfgang Cassing

We consider a projection operator approach to the non-equilbrium Green function equation-of-motion (PO-NEGF EOM) method. The technique resolves problems of arbitrariness in truncation of an infinite chain of EOMs, and prevents violation of…

Mesoscale and Nanoscale Physics · Physics 2014-10-28 Maicol A. Ochoa , Michael Galperin , Mark A. Ratner