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On the basis of a Berry-phase analysis, we study the ground state of the $J_1$-$J_2$ Heisenberg chain for $S=2,3,4$. We find that changes of the Berry phase occur $S$ times for spin-$S$ systems, indicating the sequential phase transitions.…

Strongly Correlated Electrons · Physics 2019-08-07 Shota Fubasami , Tomonari Mizoguchi , Yasuhiro Hatsugai

We formulate a quantum Monte Carlo (QMC) method for calculating the ground state of many-boson systems. The method is based on a field-theoretical approach, and is closely related to existing fermion auxiliary-field QMC methods which are…

Computational Physics · Physics 2009-11-10 Wirawan Purwanto , Shiwei Zhang

Quantum Monte Carlo methods are sophisticated numerical techniques for simulating interacting quantum systems. In some cases, however, they suffer from the notorious "sign problem" and become too inefficient to be useful. A recent…

Strongly Correlated Electrons · Physics 2008-05-16 K. S. D. Beach , Matthieu Mambrini , Fabien Alet

A review of the Loop Algorithm, its generalizations, and its relation to some other Monte Carlo techniques is given. The loop algorithm is a Quantum Monte Carlo procedure which employs nonlocal changes of worldline configurations,…

Strongly Correlated Electrons · Physics 2014-10-13 H. G. Evertz

We characterize several phases of gapped spin systems by local order parameters defined by quantized Berry phases. This characterization is topologically stable against any small perturbation as long as the energy gap remains finite. The…

Strongly Correlated Electrons · Physics 2008-08-18 Takaaki Hirano , Hosho Katsura , Yasuhiro Hatsugai

We present a new class of algorithms for performing valence-bond quantum Monte Carlo of quantum spin models. Valence-bond quantum Monte Carlo is a T=0 Monte Carlo method based on sampling of a set of operator-strings that can be viewed as…

Computational Physics · Physics 2014-09-16 Andreas Deschner , Erik S. Sørensen

We describe and discuss a recently proposed quantum Monte Carlo algorithm to compute the ground-state properties of various systems of interacting fermions. In this method, the ground state is projected from an initial wave function by a…

Condensed Matter · Physics 2009-10-28 Shiwei Zhang , J. Carlson , J. E. Gubernatis

Due to the intrinsic complexity of the quantum many-body problem, quantum Monte Carlo algorithms and their corresponding Monte Carlo configurations can be defined in various ways. Configurations corresponding to few Feynman diagrams often…

Strongly Correlated Electrons · Physics 2019-04-30 Alexander Kowalski , Andreas Hausoel , Markus Wallerberger , Patrik Gunacker , Giorgio Sangiovanni

We show how efficient loop updates, originally developed for Monte Carlo simulations of quantum spin systems at finite temperature, can be combined with a ground-state projector scheme and variational calculations in the valence bond basis.…

Strongly Correlated Electrons · Physics 2010-07-14 A. W. Sandvik , H. G. Evertz

In recent years, a better understanding of the Monte Carlo method has provided us with many new techniques in different areas of statistical physics. Of particular interest are so called cluster methods, which exploit the considerable…

Statistical Mechanics · Physics 2007-05-23 Werner Krauth

We introduce two novel quantum Monte Carlo methods and employ them to study the superfluid-insulator transition in a two-dimensional system of hard-core bosons. One of the methods is appropriate for zero temperature and is based upon…

Condensed Matter · Physics 2009-10-22 Shiwei Zhang , N. Kawashima , J. Carlson , J. E. Gubernatis

The stochastic series expansion quantum Monte Carlo method is used to study thin ferromagnetic films, described by a Heisenberg model including local anisotropies. The magnetization curve is calculated, and the results compared to Schwinger…

Strongly Correlated Electrons · Physics 2009-11-07 P. Henelius , P. Fröbrich , P. J. Kuntz , C. Timm , P. J. Jensen

The state-of-the-art theoretical description of magnetic materials relies on solving effective Heisenberg spin problems or their generalizations to relativistic or multi-spin-interaction cases that explicitly assume the presence of local…

Strongly Correlated Electrons · Physics 2022-04-27 E. A. Stepanov , S. Brener , V. Harkov , M. I. Katsnelson , A. I. Lichtenstein

The Markov chain Monte Carlo (MCMC) method is used to evaluate the imaginary-time path integral of a quantum oscillator with a potential that includes both a quadratic term and a quartic term whose coupling is varied by several orders of…

Computational Physics · Physics 2020-08-27 Shikhar Mittal , Marise J. E. Westbroek , Peter R. King , Dimitri D. Vvedensky

A large-scale parallel loop cluster quantum Monte Carlo simulation is presented. On 24,576 nodes of the K computer, one loop cluster Monte Carlo update of the world-line configuration of the $S=1/2$ antiferromagnetic Heisenberg chain with…

Strongly Correlated Electrons · Physics 2019-06-26 Synge Todo , Haruhiko Matsuo , Hideyuki Shitara

We propose a new quantum Monte Carlo algorithm to compute fermion ground-state properties. The ground state is projected from an initial wavefunction by a branching random walk in an over-complete basis space of Slater determinants. By…

Condensed Matter · Physics 2016-08-31 Shiwei Zhang , J. Carlson , J. E. Gubernatis

A classical Monte Carlo algorithm based on the quasi-classical approximation is applied to the pseudospin Hamiltonian of the model cuprate. The model takes into account both local and non-local correlations, Heisenberg spin-exchange…

Computational Physics · Physics 2026-01-01 V. A. Ulitko , Yu. D. Panov , A. S. Moskvin

We have used the variational and diffusion quantum Monte Carlo methods to calculate the energy, pair correlation function, static structure factor, and momentum density of the ground state of the two-dimensional homogeneous electron gas. We…

Mesoscale and Nanoscale Physics · Physics 2010-03-02 N. D. Drummond , R. J. Needs

We investigate the inclusion of variable spins in electronic structure quantum Monte Carlo, with a focus on diffusion Monte Carlo with Hamiltonians that include spin-orbit interactions. Following our previous introduction of fixed-phase…

Computational Physics · Physics 2016-07-27 Cody A. Melton , M. Chandler Bennett , Lubos Mitas

We discuss the sign problem arising in Monte Carlo simulations of frustrated quantum spin systems. We show that for a class of ``semi-frustrated'' systems (Heisenberg models with ferromagnetic couplings $J_z(r) < 0$ along the $z$-axis and…

Strongly Correlated Electrons · Physics 2009-10-31 Patrik Henelius , Anders W. Sandvik