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We present new analytic continuation results for the dynamic structure factor $S(\mathbf{q},\omega)$ of the uniform electron liquid based on quasi-exact \emph{ab initio} path integral Monte Carlo (PIMC) data for the imaginary-time…

Computational Physics · Physics 2026-03-31 Thomas Chuna , Maximilian P. Böhme , Tobias Dornheim

We introduce an exact framework to compute the positive frequency moments $M^{(\alpha)}(\mathbf{q})=\braket{\omega^\alpha}$ of different dynamic properties from imaginary-time quantum Monte Carlo data. As a practical example, we obtain the…

In a recent Letter [T. Dornheim et al., Phys. Rev. Lett. 121, 255001 (2018)] we have presented the first ab initio results for the dynamic structure factor $S(\mathbf{q},\omega)$ of the uniform electron gas for conditions ranging from the…

Plasma Physics · Physics 2019-06-19 Simon Groth , Tobias Dornheim , Jan Vorberger

The \emph{ab initio} path integral Monte Carlo (PIMC) approach is one of the most successful methods in quantum many-body theory. A particular strength of this method is its straightforward access to imaginary-time correlation functions…

Statistical Mechanics · Physics 2021-08-25 Tobias Dornheim , Zhandos A. Moldabekov , Jan Vorberger

We evaluate imaginary time density-density correlation functions for a two-dimensional homogeneous electron gas using the phaseless auxiliary field quantum Monte Carlo method. We show that such methodology, once equipped with suitable…

Strongly Correlated Electrons · Physics 2015-09-04 M. Motta , D. E. Galli , S. Moroni , E. Vitali

Within the imaginary-time theory for nonequilibrium in quantum dot systems the calculation of dynamical quantities like Green's functions is possible via a suitable quantum Monte-Carlo algorithm. The challenging task is to analytically…

Strongly Correlated Electrons · Physics 2013-07-04 Andreas Dirks , Jong E. Han , Mark Jarrell , Thomas Pruschke

The accurate description of electrons at extreme density and temperature is of paramount importance for, e.g., the understanding of astrophysical objects and inertial confinement fusion. In this context, the dynamic structure factor…

Plasma Physics · Physics 2018-12-26 T. Dornheim , S. Groth , J. Vorberger , M. Bonitz

We present a method based on the Path Integral Monte Carlo formalism for the calculation of ground-state time correlation functions in quantum systems. The key point of the method is the consideration of time as a complex variable whose…

Statistical Mechanics · Physics 2015-06-24 Riccardo Rota , Joaquim Casulleras , Ferran Mazzanti , Jordi Boronat

The phaseless Auxiliary Field Quantum Monte Carlo method provides a well established approximation scheme for accurate calculations of ground state energies of many-fermions systems. Here we apply the method to the calculation of imaginary…

Strongly Correlated Electrons · Physics 2015-06-17 M. Motta , D. E. Galli , S. Moroni , E. Vitali

The rigorous diagnostics of experiments with warm dense matter (WDM) is notoriously difficult. A key method is given by X-ray Thomson scattering (XRTS), but the interpretation of XRTS measurements is usually based on theoretical models that…

Statistical Mechanics · Physics 2022-11-02 Tobias Dornheim , Jan Vorberger , Zhandos Moldabekov , Maximilian Böhme

Understanding the dynamic properties of the uniform electron gas (UEG) is important for numerous applications ranging from semiconductor physics to exotic warm dense matter. In this work, we apply the maximum entropy method (MEM), as…

Strongly Correlated Electrons · Physics 2025-09-19 Thomas Chuna , Nicholas Barnfield , Jan Vorberger , Michael P. Friedlander , Tim Hoheisel , Tobias Dornheim

Understanding the real time dynamics of quantum systems without quasiparticles constitutes an important yet challenging problem. We study the superfluid-insulator quantum-critical point of bosons on a two-dimensional lattice, a system whose…

Strongly Correlated Electrons · Physics 2014-05-06 William Witczak-Krempa , Erik Sorensen , Subir Sachdev

The Quantum Monte Carlo (QMC) method can yield the imaginary-time dependence of a correlation function $C(\tau)$ of an operator $\hat O$. The analytic continuation to real-time proceeds by means of a "numerical inversion" of these data to…

Strongly Correlated Electrons · Physics 2015-03-11 Nikolaos G. Diamantis , Efstratios Manousakis

A method for analytic continuation of imaginary-time correlation functions (here obtained in quantum Monte Carlo simulations) to real-frequency spectral functions is proposed. Stochastically sampling a spectrum parametrized by a large…

Strongly Correlated Electrons · Physics 2017-06-30 Anders W. Sandvik

Some time ago, Cuniberti et al have proposed a novel method for analytically continuing thermal imaginary-time correlators to real time, which requires no model input and should be applicable with finite-precision data as well. Given that…

High Energy Physics - Lattice · Physics 2011-05-05 Y. Burnier , M. Laine , L. Mether

The recently derived Fourier--Matsubara expansion of imaginary--time correlation functions comprises an exact result of linear response theory for finite-temperature quantum many-body systems. In its density--density version, the expansion…

An efficient Path Integral Monte Carlo procedure is proposed to simulate the behavior of quantum many-body dissipative systems described within the framework of the influence functional. Thermodynamic observables are obtained by Monte Carlo…

Statistical Mechanics · Physics 2009-11-07 Luca Capriotti , Alessandro Cuccoli , Andrea Fubini , Valerio Tognetti , Ruggero Vaia

We systematically investigate finite-size effects in the dynamic structure factor $S(q,\omega)$ of the uniform electron gas obtained via the analytic continuation of \textit{ab initio} path integral Monte-Carlo (PIMC) data for the…

Strongly Correlated Electrons · Physics 2020-12-30 Tobias Dornheim , Jan Vorberger

Theoretical analysis typically involves imaginary-time correlation functions. Inferring real-time dynamical response functions from this information is notoriously difficult. However, as we articulate here, it is straightforward to compute…

Strongly Correlated Electrons · Physics 2020-06-02 S. Lederer , D. Jost , T. Böhm , R. Hackl , E. Berg , S. Kivelson

Precise calculations of dynamics in the homogeneous electron gas (jellium model) are of fundamental importance for design and characterization of new materials. We introduce a diagrammatic Monte Carlo technique based on algorithmic…

Strongly Correlated Electrons · Physics 2022-12-21 James P. F. LeBlanc , Kun Chen , Kristjan Haule , Nikolay V. Prokof'ev , Igor S. Tupitsyn
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