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The conventional second-order Path Integral Monte Carlo method is plagued with the sign problem in solving many-fermion systems. This is due to the large number of anti-symmetric free fermion propagators that are needed to extract the…

Computational Physics · Physics 2015-06-23 Siu A. Chin

Two-particle Green's functions and the vertex functions play a critical role in theoretical frameworks for describing strongly correlated electron systems. However, numerical calculations at two-particle level often suffer from large…

Strongly Correlated Electrons · Physics 2018-05-16 Hiroshi Shinaoka , Junya Otsuki , Kristjan Haule , Markus Wallerberger , Emanuel Gull , Kazuyoshi Yoshimi , Masayuki Ohzeki

The principle and the efficiency of the Monte Carlo transfer-matrix algorithm are discussed. Enhancements of this algorithm are illustrated by applications to several phase transitions in lattice spin models. We demonstrate how the…

Condensed Matter · Physics 2009-10-28 M. P. Nightingale , H. W. J. Bloete

We present a novel method for precise numerical solution of the irreducible two-body problem and apply it to excitons in solids. The approach is based on the Monte Carlo simulation of the two-body Green function specified by Feynman's…

Strongly Correlated Electrons · Physics 2009-11-07 E. A. Burovski , A. S. Mishchenko , N. V. Prokof'ev , B. V. Svistunov

We study cluster perturbation theory [Phys. Rev. Lett. \textbf{84}, 522 (2000)] when auxiliary field quantum Monte Carlo method is used for solving the cluster hamiltonian. As a case study, we calculate the spectral functions of the Hubbard…

Strongly Correlated Electrons · Physics 2007-05-23 Fei Lin , Erik S. Sorensen , Catherine Kallin , A. John Berlinsky

We study non-equilibrium electron transport through a quantum dot coupled to metallic leads. We use an alternative equation of motion approach in which we calculate the retarded Green function of the impurity by differentiating Green…

Mesoscale and Nanoscale Physics · Physics 2014-12-23 Grzegorz Górski , Jerzy Mizia , Krzysztof Kucab

We show how to apply the absorbing Markov chain Monte Carlo algorithm of Novotny to simulate kinetically constrained models of glasses. We consider in detail one-spin facilitated models, such as the East model and its generalizations to…

Statistical Mechanics · Physics 2009-11-11 Douglas J. Ashton , Lester O. Hedges , Juan P. Garrahan

We implement Monte Carlo Renormalization Group (MCRG) in the continuous-time Monte Carlo simulation of a quantum system. We demonstrate numerically the emergent isotropy between space and time at large distances for the systems that exhibit…

Statistical Mechanics · Physics 2020-10-07 Yantao Wu , Roberto Car

In Monte Carlo integration an accurate and reliable determination of the numerical intregration error is essential. We point out the need for an independent estimate of the error on this error, for which we present an unbiased estimator. In…

Numerical Analysis · Mathematics 2016-10-12 R. Bakx , R. H. P. Kleiss , F. Versteegen

Wave-function Monte Carlo methods are an important tool for simulating quantum systems, but the standard method cannot be used to simulate decoherence in continuously measured systems. Here we present a new Monte Carlo method for such…

Quantum Physics · Physics 2013-05-29 Kurt Jacobs

We introduce two kinds of quantum algorithms to explore microcanonical and canonical properties of many-body systems. The first one is a hybrid quantum algorithm that, given an efficiently preparable state, computes expectation values in a…

Quantum Physics · Physics 2021-05-19 Sirui Lu , Mari Carmen Bañuls , J. Ignacio Cirac

Analytic continuation (AC) from imaginary-time Green's function to spectral function is essential in the numerical analysis of dynamical properties in quantum many-body systems. However, this process faces a fundamental challenge: it is an…

Strongly Correlated Electrons · Physics 2024-09-04 Yuichi Motoyama , Hiroshi Shinaoka , Junya Otsuki , Kazuyoshi Yoshimi

We present a quantum Monte Carlo algorithm for the simulation of general quantum and classical many-body models within a single unifying framework. The algorithm builds on a power series expansion of the quantum partition function in its…

Statistical Mechanics · Physics 2020-08-05 Lalit Gupta , Tameem Albash , Itay Hen

We propose a new scheme to implement the self-consistent optimization of the trial wave-function in constrained path auxiliary field Quantum Monte Carlo (CP-AFQMC) in the framewok of natural orbitals. In this scheme, a new trial…

Strongly Correlated Electrons · Physics 2023-08-15 Mingpu Qin

Efficient variance reduction of Monte Carlo simulations is desirable to avoid wasting computational resources. This paper presents an automated weight window algorithm for solving time-dependent particle transport problems. The weight…

Numerical Analysis · Mathematics 2025-08-06 Caleb S. Shaw , Dmitriy Y. Anistratov

We address the calculation of dynamical correlation functions for many fermion systems at zero temperature, using the auxiliary-field quantum Monte Carlo method. The two-dimensional Hubbard hamiltonian is used as a model system. Although…

Strongly Correlated Electrons · Physics 2016-08-24 Ettore Vitali , Hao Shi , Mingpu Qin , Shiwei Zhang

Quantum Monte Carlo and quantum simulation are both important tools for understanding quantum many-body systems. As a classical algorithm, quantum Monte Carlo suffers from the sign problem, preventing its application to most fermion systems…

Quantum Physics · Physics 2022-01-06 Yongdan Yang , Bing-Nan Lu , Ying Li

We present the first Green's function Monte Carlo calculations of light nuclei with nuclear interactions derived from chiral effective field theory up to next-to-next-to-leading order. Up to this order, the interactions can be constructed…

Nuclear Theory · Physics 2014-11-11 J. E. Lynn , J. Carlson , E. Epelbaum , S. Gandolfi , A. Gezerlis , A. Schwenk

In the Majorana representation of a spin 1/2 we find an identity which relates spin-spin correlators to one-particle fermionic correlators. This should be contrasted with the straightforward approach in which two-particle (four-fermion)…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Alexander Shnirman , Yuriy Makhlin

A precise dynamical characterization of quantum impurity models with multiple interacting orbitals is challenging. In quantum Monte Carlo methods, this is embodied by sign problems. A dynamical sign problem makes it exponentially difficult…

Mesoscale and Nanoscale Physics · Physics 2024-07-02 Andre Erpenbeck , Thomas Blommel , Lei Zhang , Wei-Ting Lin , Guy Cohen , Emanuel Gull