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Thermofield dynamics (TFD) is a powerful framework to account for thermal effects in a wavefunction setting, and has been extensively used in physics and quantum optics. TFD relies on a duplicated state space and creates a correlated…

Quantum Physics · Physics 2026-02-20 Bartosz Błasiak , Dominik Brey , Rocco Martinazzo , Irene Burghardt

The most general description of quantum evolution up to a time $\tau$ is a completely positive tracing preserving map known as a dynamical map $\hat{\Lambda}(\tau)$. Here we consider $\hat{\Lambda}(\tau)$ arising from suddenly coupling a…

Quantum Physics · Physics 2024-10-28 David J. Strachan , Archak Purkayastha , Stephen R. Clark

We consider a fermionic quantum system exchanging particles with an environment at a fixed temperature and study its reduced evolution by means of a Redfield-I equation with time-dependent (non-Markovian) coefficients. We find that the…

Mesoscale and Nanoscale Physics · Physics 2025-02-04 Lukas Litzba , Eric Kleinherbers , Jürgen König , Ralf Schützhold , Nikodem Szpak

Reduced basis methods provide an efficient way of mapping out phase diagrams of strongly correlated many-body quantum systems. The method relies on using the exact solutions at select parameter values to construct a low-dimensional basis,…

Strongly Correlated Electrons · Physics 2026-05-05 Hans Christiansen , Virgil V. Baran , Jens Paaske

In a recent paper we have suggested that the finite temperature density matrix can be computed efficiently by a combination of polynomial expansion and iterative inversion techniques. We present here significant improvements over this…

Materials Science · Physics 2010-10-19 Michele Ceriotti , Thomas D. Kühne , Michele Parrinello

A finite-dimensional quantum system is coupled to a bath of oscillators in thermal equilibrium at temperature $T>0$. We show that for fixed, small values of the coupling constant $\lambda$, the true reduced dynamics of the system is…

Quantum Physics · Physics 2022-01-05 Marco Merkli

We present a new, computationally inexpensive method for the calculation of reduced density matrix dynamics for systems with a potentially large number of subsystem degrees of freedom coupled to a generic bath. The approach consists of…

Chemical Physics · Physics 2015-12-09 Andrés Montoya-Castillo , Timothy C. Berkelbach , David R. Reichman

We present a finite-temperature extension of density matrix embedding theory (FT-DMET) for realistic crystalline systems. We describe a practical framework for constructing extended bath orbitals, solving the embedding problem, and…

Computational Physics · Physics 2026-01-06 Laurence Giordano , Y. Stanley Tan , Zhi-Hao Cui , Chong Sun

To describe non-equilibrium transport processes in a quantum device with infinite baths, we propose to formulate the problems as a reduced-order problem. Starting with the Liouville-von Neumann equation for the density-matrix, the…

Mesoscale and Nanoscale Physics · Physics 2019-11-04 Weiqi Chu , Xiantao Li

We study the phase diagram and finite temperature properties of an integrable generalization of the one-dimensional super-symmetric t-J model containing interactions explicitly breaking parity-time reversal (PT) symmetries. To this purpose,…

Statistical Mechanics · Physics 2017-08-08 T. S. Tavares , G. A. P. Ribeiro

We present an \textit{ab initio} theory for superconductors, based on a unique mapping between the statistical density operator at equilibrium, on the one hand, and the corresponding one-body reduced density matrix $\gamma$ and the…

Superconductivity · Physics 2019-06-06 Jonathan Schmidt , Carlos L. Benavides-Riveros , Miguel A. L. Marques

A general method for numerical computation of the thermal density matrix of a single-particle quantum system is presented. The Schrodinger equation in imaginary time tau is solved numerically by the finite difference time domain (FDTD)…

Computational Physics · Physics 2009-02-12 I. Wayan Sudiarta , D. J. Wallace Geldart

A novel 3-D higher-order finite-difference time-domain framework with complex frequency-shifted perfectly matched layer for the modeling of wave propagation in cold plasma is presented. Second- and fourth-order spatial approximations are…

Plasma Physics · Physics 2013-10-25 Konstantinos P. Prokopidis

Simulating electron-nucleus coupled dynamics poses a non-trivial challenge and an important problem in the investigation of ultrafast processes involving coupled electronic and vibrational dynamics. Because irreversibility of the system…

Chemical Physics · Physics 2019-04-11 Tatsushi Ikeda , Yoshitaka Tanimura

Density matrices are powerful mathematical tools for the description of closed and open quantum systems. Recently, methods for the direct computation of density matrix elements in scalar quantum field theory were developed based on thermo…

High Energy Physics - Theory · Physics 2025-03-12 Christian Käding , Mario Pitschmann

An exact and efficient new method to simulate dynamics in dissipative quantum systems is presented. A stochastic Liouville equation, deduced from Feynman and Vernon's path-integral expression of the reduced density matrix, is used to…

Statistical Mechanics · Physics 2009-10-31 J. Stockburger , C. H. Mak

We study the thermalization properties of one-dimensional open quantum systems coupled to baths at their boundary. The baths are driven to their thermal states via Lindblad operators, while the system undergoes Hamiltonian dynamics. We…

Strongly Correlated Electrons · Physics 2023-08-02 Cristian Zanoci , Yongchan Yoo , Brian Swingle

Time domain simulations of electromagnetic problems are highly valuable in engineering applications, as they allow for the analysis of transient behavior and broadband responses. These simulations utilize time stepping schemes, where each…

Computational Physics · Physics 2024-10-23 Ruth Medeiros , Valentin de la Rubia

The extended Falicov-Kimball model is analyzed exactly for finite temperatures ($T\geq0$) in the limit of large dimensions. Onsite and intersite density-density interactions $U$ and $V$ are included in the model. Using the dynamical mean…

Strongly Correlated Electrons · Physics 2019-06-26 Konrad Jerzy Kapcia , Romuald Lemański , Stanisław Robaszkiewicz

In this study, we explore mixed-dimensional Thermo-Hydro-Mechanical (THM) models in fractured porous media accounting for Coulomb frictional contact at matrix fracture interfaces. The simulation of such models plays an important role in…

Numerical Analysis · Mathematics 2024-01-24 Jerome Droniou , Mohamed Laaziri , Roland Masson
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