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The numerical solution of the many-body problem of interacting electrons and ions is a key challenge in condensed matter physics, chemistry, and materials science. Traditional methods to solve the multi-component quantum Hamiltonian are…

Materials Science · Physics 2025-10-24 Lorenzo Monacelli , Antonio Siciliano , Nicola Marzari

We present a symmetry-enabled direct quantum protocol for computing many-body Green's functions, a central tool for studying strongly correlated quantum systems. Our protocol relies only on native time evolution and straightforward…

Quantum Physics · Physics 2026-03-03 Changhao Yi , Cunlu Zhou

Recent quantum algorithms pertaining to electronic structure theory primarily focus on threshold-based dynamic construction of ansatz by selectively including important many-body operators. These methods can be made systematically more…

Quantum Physics · Physics 2024-08-26 Chayan Patra , Debaarjun Mukherjee , Sonaldeep Halder , Dibyendu Mondal , Rahul Maitra

This paper extends an earlier quantum kinetics treatment for dilute, weakly-interacting, partially Bose-Einstein condensed gases, presented by the author elsewhere [J. Res. Natl. Inst. Stand. Technol. 101, 457 (1996)], by consistently…

Condensed Matter · Physics 2009-11-07 N. P. Proukakis

Complete information on the equilibrium behaviour and dynamics of a quantum field theory (QFT) is provided by multipoint correlation functions. However, their theoretical calculation is a challenging problem, even for exactly solvable…

Statistical Mechanics · Physics 2018-09-19 Ivan Kukuljan , Spyros Sotiriadis , Gabor Takacs

Performance of quantum process estimation is naturally limited to fundamental, random, and systematic imperfections in preparations and measurements. These imperfections may lead to considerable errors in the process reconstruction due to…

Quantum Physics · Physics 2010-03-16 M. Mohseni , A. T. Rezakhani , J. T. Barreiro , P. G. Kwiat , A. Aspuru-Guzik

One of the most important quantities characterizing the microscopic properties of quantum systems are dynamical correlation functions. These correlations are obtained by time-evolving a perturbation of an eigenstate of the system, typically…

Quantum Physics · Physics 2025-02-26 Reinis Irmejs , Raul A. Santos

We present a method that permits the calculation of the dynamical correlation functions for quantum systems. These are obtained by evaluating the generating functionals of the static moments of the relaxation functions in a self-consistent…

Statistical Mechanics · Physics 2009-10-30 A. Cuccoli , R. Giachetti , V. Tognetti , R. Vaia

Non-equilibrium Green's Function (NGF) method is a powerful tool for studying the evolution of quantum many-body systems. Different types of correlations can be systematically incorporated within the formalism. The time evolution of the…

Nuclear Theory · Physics 2018-01-17 M. H. Mahzoon , P. Danielewicz , A. Rios

We study the accuracy of analytical wave function based many-body methods derived by energy minimization of a Jastrow-Feenberg ansatz for electrons (`Fermi hypernetted chain / Euler Lagrange' approach). Approximations to avoid the…

Other Condensed Matter · Physics 2019-06-05 Martin Panholzer , Raphael Hobbiger , Helga Böhm

Multitime quantum correlation functions are central objects in physical science, offering a direct link between experimental observables and the dynamics of an underlying model. While experiments such as 2D spectroscopy and quantum control…

Chemical Physics · Physics 2024-07-10 Thomas Sayer , Andrés Montoya-Castillo

Quantum simulators have made a remarkable progress towards exploring the dynamics of many-body systems, many of which offer a formidable challenge to both theoretical and numerical methods. While state-of-the-art quantum simulators are in…

This article presents an overview on recent progress in the theory of nonequilibrium Green functions (NEGF). NEGF, presently, are the only \textit{ab-initio} quantum approach that is able to study the dynamics of correlations for long times…

Strongly Correlated Electrons · Physics 2019-12-20 N. Schluenzen , S. Hermanns , M. Scharnke , M. Bonitz

We present a numerical method to compute non-equilibrium memory kernels based on experimental data or molecular dynamics simulations. The procedure uses a recasting of the non-stationary generalized Langevin equation, in which we expand the…

Statistical Mechanics · Physics 2019-05-29 Hugues Meyer , Philipp Pelagejcev , Tanja Schilling

We use the full-density matrix (FDM) numerical renormalization group (NRG) method to calculate the equilibrium dynamical correlation function $C(\omega)$ of the spin operator $\sigma_z$ at finite temperature for the sub-Ohmic spin-boson…

Strongly Correlated Electrons · Physics 2022-02-11 Ke Yang , Ning-Hua Tong

We propose to measure nonadiabaticity of molecular quantum dynamics rigorously with the quantum fidelity between the Born-Oppenheimer and fully nonadiabatic dynamics. It is shown that this measure of nonadiabaticity applies in situations…

Chemical Physics · Physics 2012-06-28 Tomas Zimmermann , Jiri Vanicek

Simulating the unitary dynamics of a quantum system is a fundamental problem of quantum mechanics, in which quantum computers are believed to have significant advantage over their classical counterparts. One prominent such instance is the…

Quantum Physics · Physics 2024-09-04 John M. Martyn , Yuan Liu , Zachary E. Chin , Isaac L. Chuang

A link between memory effects in quantum kinetic equations and nonequilibrium correlations associated with the energy conservation is investigated. In order that the energy be conserved by an approximate collision integral, the one-particle…

Statistical Mechanics · Physics 2007-05-23 V. G. Morozov , Gerd Ropke

The computation of dynamical response functions is central to many problems in condensed matter physics. Owing to the rapid growth of quantum correlations following a quench, classical methods face significant challenges even if an…

Quantum Physics · Physics 2025-05-09 Esther Cruz , Dominik S. Wild , Mari Carmen Bañuls , J. Ignacio Cirac

We investigate the potential of a quantum Boltzmann equation without momentum conservation for description of strongly correlated electron systems out of equilibrium. In a spirit similar to dynamical mean field theory (DMFT), the momentum…

Strongly Correlated Electrons · Physics 2018-11-07 Michael Wais , Martin Eckstein , Roland Fischer , Philipp Werner , Marco Battiato , Karsten Held