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This review covers applications of quantum Monte Carlo methods to quantum mechanical problems in the study of electronic and atomic structure, as well as applications to statistical mechanical problems both of static and dynamic nature. The…

chem-ph · Physics 2016-10-26 M. P. Nightingale , C. J. Umrigar

We investigate the magnetic phases of triangular graphene quantum dots (TGQDs) with zigzag edges using variational and quantum Monte Carlo methods. These systems serve as quantum simulators for bipartite lattices with broken sublattice…

Mesoscale and Nanoscale Physics · Physics 2025-10-03 E. Bulut Kul , Gökhan Öztarhan , M. N. Çınar , A. D. Güçlü

We investigate an extended version of the periodic Anderson model (the so-called periodic Anderson-Hubbard model) with the aim to understand the role of interaction between conduction electrons in the formation of the heavy-fermion and…

Strongly Correlated Electrons · Physics 2013-05-30 I. Hagymasi , K. Itai , J. Solyom

The implementation and reliability of a quadratic diffusion Monte Carlo method for the study of ground-state properties of atoms are discussed. We show in the simple yet non-trivial calculation of the binding energy of the Li atom that the…

Condensed Matter · Physics 2009-11-07 A. Sarsa , J. Boronat , J. Casulleras

We provide a pedagogical introduction to the two main variants of real-space quantum Monte Carlo methods for electronic-structure calculations: variational Monte Carlo (VMC) and diffusion Monte Carlo (DMC). Assuming no prior knowledge on…

Chemical Physics · Physics 2015-08-13 Julien Toulouse , Roland Assaraf , C. J. Umrigar

We present an extension of constrained-path auxiliary-field quantum Monte Carlo (CP-AFQMC) for the treatment of correlated electronic systems coupled to phonons. The algorithm follows the standard CP-AFQMC approach for description of the…

Strongly Correlated Electrons · Physics 2021-03-24 Joonho Lee , Shiwei Zhang , David R. Reichman

Monte Carlo evaluation is used to calculate heavy-ion elastic scattering including the center-of-mass correction and the Coulomb interaction.Angular distributions are presented for a number of nuclear pairs over a wide energy range using…

Nuclear Theory · Physics 2015-06-04 W. R. Gibbs , Jean-Pierre Dedonder

We review the recently proposed extension of the Gutzwiller approximation, M. Schiro' and M. Fabrizio, Phys. Rev. Lett. 105, 076401 (2010), designed to describe the out-of-equilibrium time-evolution of a Gutzwiller-type variational wave…

Strongly Correlated Electrons · Physics 2015-06-04 Michele Fabrizio

To shed light into the pairing mechanism of possible spin-triplet superconductors (TMTSF)$_2$X and Sr$_2$RuO$_4$, we study the competition among various spin singlet and triplet pairing channels in the Hubbard model by calculating the…

Strongly Correlated Electrons · Physics 2009-11-10 Kazuhiko Kuroki , Yukio Tanaka , Takashi Kimura , Ryotaro Arita

We provide a unified, comprehensive treatment of all operators that contribute to the anti-ferromagnetic, ferromagnetic, and charge-density-wave structure factors and order parameters of the hexagonal Hubbard Model. We use the Hybrid Monte…

Strongly Correlated Electrons · Physics 2021-11-01 Johann Ostmeyer , Evan Berkowitz , Stefan Krieg , Timo A. Lähde , Thomas Luu , Carsten Urbach

Monte Carlo simulations of the 4d O(4) model in the broken phase are performed to determine the parameters of a resonance. The standard method for extracting them on the lattice is through L\"uscher's formula; recently a new method, based…

High Energy Physics - Lattice · Physics 2011-01-25 Pietro Giudice , Darran McManus , Mike Peardon

An algorithm is proposed to optimize quantum Monte Carlo (QMC) wave functions based on New ton's method and analytical computation of the first and second derivatives of the variati onal energy. This direct application of the variational…

Chemical Physics · Physics 2016-09-08 Xi Lin , Hongkai Zhang , Andrew M. Rappe

We review the method of stochastic error correction which eliminates the truncation error associated with any subspace diagonalization. Monte Carlo sampling is used to compute the contribution of the remaining basis vectors not included in…

High Energy Physics - Lattice · Physics 2009-10-31 Dean Lee

We consider an effective Hubbard model with spin- and direction-dependent complex hoppings $t$, applied to twisted homobilayer WSe$_2$ using a variational Monte Carlo approach. The electronic correlations are taken into account by applying…

Strongly Correlated Electrons · Physics 2024-01-10 Andrzej Biborski , Paweł Wójcik , Michał Zegrodnik

Recently the general form of a translation-covariant quantum Boltzmann equation has been derived which describes the dynamics of a tracer particle in a quantum gas. We develop a stochastic wave function algorithm that enables full…

Quantum Physics · Physics 2007-09-24 Heinz-Peter Breuer , Bassano Vacchini

A variational ground state of the repulsive Hubbard model on a square lattice is investigated numerically for an intermediate coupling strength (U = 8t) and for moderate sizes (from 6 x 6 to 10 x 10). Our ansatz is clearly superior to other…

Strongly Correlated Electrons · Physics 2009-11-13 D. Eichenberger , D. Baeriswyl

We investigate numerically the magnetic properties of the 3D Isotropic and Anisotropic Hubbard model at half-filling. The behavior of the transition temperature as a function of the anisotropic hopping parameter is qualitatively described.…

Strongly Correlated Electrons · Physics 2007-05-23 Isabel Campos , James W. Davenport

Superconductivity in the Hubbard model on a square lattice near half filling is studied using an optimization (or correlated) variational Monte Carlo method. Second-order processes of the strong-coupling expansion are considered in the wave…

Strongly Correlated Electrons · Physics 2009-11-10 Hisatoshi Yokoyama , Yukio Tanaka , Masao Ogata , Hiroki Tsuchiura

A fully relativistic quark model is constructed and applied to the study of wave-functions as well as the spectrum of heavy-light mesons. The free parameters of the model are a constituent quark mass and (on the lattice) an adjustable…

High Energy Physics - Phenomenology · Physics 2009-10-28 S. A. Pernice

The construction of trial wave functions based on neural networks combined with the variational Monte Carlo method is discussed. The mathematical formulation for representing quantum states as artificial neural networks is introduced. The…

Computational Physics · Physics 2026-05-19 William Freitas
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