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Auxiliary Field Quantum Monte Carlo (AFQMC) has emerged as a powerful framework for treating strongly correlated electronic systems, offering a favorable balance between computational cost and accuracy. In this paper, we present a novel…

Chemical Physics · Physics 2026-04-03 Maxine Luo , Victor Chen , Yu Wang , Christian B. Mendl

We investigate the sign problem for full configuration interaction quantum Monte Carlo (FCIQMC), a stochastic algorithm for finding the ground state solution of the Schr\"odinger equation with substantially reduced computational cost…

Computational Physics · Physics 2014-11-05 James J. Shepherd , Gustavo E. Scuseria , James S. Spencer

We apply two ab initio many-body methods based on Gutzwiller wave functions, i.e., correlation matrix renormalization theory (CMRT) and Gutzwiller conjugate gradient minimization (GCGM), to the study of crystalline phases of atomic…

Strongly Correlated Electrons · Physics 2025-10-06 Zhuo Ye , Jun Liu , Yong-Xin Yao , Feng Zhang , Kai-Ming Ho , Cai-Zhuang Wang

Gaussian Quantum Monte Carlo (GQMC) is a stochastic phase space method for fermions with positive weights. In the example of the Hubbard model close to half filling it fails to reproduce all the symmetries of the ground state leading to…

Strongly Correlated Electrons · Physics 2008-03-04 P. Corboz , A. Kleine , F. F. Assaad , I. P. McCulloch , U. Schollwöck , M. Troyer

Here, we investigate the fractal-lattice Hubbard model using various numerical methods: exact diagonalization, the self-consistent diagonalization of a (mean-field) Hartree-Fock Hamiltonian and state-of-the-art Auxiliary-Field Quantum Monte…

Strongly Correlated Electrons · Physics 2024-09-18 Monica Conte , Vinicius Zampronio , Malte Röntgen , Cristiane Morais Smith

In this work, results are presented of Hybrid-Monte-Carlo simulations of the tight-binding Hamiltonian of graphene, coupled to an instantaneous long-range two-body potential which is modeled by a Hubbard-Stratonovich auxiliary field. We…

High Energy Physics - Lattice · Physics 2013-11-06 Dominik Smith , Lorenz von Smekal

We report large scale determinant Quantum Monte Carlo calculations of the effective bandwidth, momentum distribution, and magnetic correlations of the square lattice fermion Hubbard Hamiltonian at half-filling. The sharp Fermi surface of…

Strongly Correlated Electrons · Physics 2010-04-07 C. N. Varney , C. -R. Lee , Z. J. Bai , S. Chiesa , M. Jarrell , R. T. Scalettar

We develop approximation methods in the hybrid quantization of the Gowdy model with linear polarization and a massless scalar field, for the case of three-torus spatial topology. The loop quantization of the homogeneous gravitational sector…

General Relativity and Quantum Cosmology · Physics 2014-12-01 Mercedes Martín-Benito , Daniel Martín-de Blas , Guillermo A. Mena Marugán

We develop a systematic self-consistent perturbative expansion for the self energy of Hubbard-like models. The interaction lines in the Feynman diagrams are dynamically screened by the charge fluctuations in the system. Although the formal…

Strongly Correlated Electrons · Physics 2007-05-23 G. Esirgen , H. -B. Schuttler , C. Grober , H. G. Evertz

The Full Configuration Interaction Quantum Monte Carlo (FCIQMC) method has proved able to provide near-exact solutions to the electronic Schr\"odinger equation within a finite orbital basis set, without relying on an expansion about a…

Computational Physics · Physics 2016-08-24 Jennifer Kersten , George H. Booth , Ali Alavi

Using a leading algorithmic implementation of the functional renormalization group (fRG) for interacting fermions on two-dimensional lattices, we provide a detailed analysis of its quantitative reliability for the Hubbard model. In…

We present a method incorporating biorthogonal orbital-optimization, symmetry projection, and double-occupancy screening with a non-unitary similarity transformation generated by the Gutzwiller factor $ n_{i\uparrow}n_{i\downarrow}$, and…

Strongly Correlated Electrons · Physics 2016-10-10 Jacob M. Wahlen-Strothman , Gustavo E. Scuseria

In this work we extend the notion of universal quantum Hamiltonians to the setting of translationally-invariant systems. We present a construction that allows a two-dimensional spin lattice with nearest-neighbour interactions, open…

Quantum Physics · Physics 2020-01-23 Stephen Piddock , Johannes Bausch

The Hubbard model represents the fundamental model for interacting quantum systems and electronic correlations. Using the two-dimensional half-filled Hubbard model at weak coupling as a testing ground, we perform a comparative study of a…

In common with many high-accuracy electronic structure methods, the initiator adaptation of full configuration interaction quantum Monte Carlo (i-FCIQMC) has difficulty treating realistic systems with large numbers of electrons. This…

Building on recent solutions of the fermion sign problem for specific models we present two continuous-time quantum Monte Carlo methods for efficient simulation of mass-imbalanced Hubbard models on bipartite lattices at half-filling. For…

Strongly Correlated Electrons · Physics 2015-12-18 Ye-Hua Liu , Lei Wang

The Hubbard model is a "highly oversimplified model" for electrons in a solid which interact with each other through extremely short ranged repulsive (Coulomb) interaction. The Hamiltonian of the Hubbard model consists of two pieces; H_hop…

Strongly Correlated Electrons · Physics 2008-02-03 Hal Tasaki

In purely repulsive, $C_{4v}$-symmetric Hubbard clusters a correlation effect produces an effective two-body attraction and pairing; the key ingredient is the availability of W=0 pairs, that is, two-body solutions of appropriate symmetry.…

Strongly Correlated Electrons · Physics 2016-08-31 Agnese Callegari , Michele Cini , Enrico Perfetto , Gianluca Stefanucci

We consider 1D lattices described by Hubbard or Bose-Hubbard models, in the presence of periodic high-frequency perturbations, such as uniform ac force or modulation of hopping coefficients. Effective Hamiltonians for interacting particles…

Other Condensed Matter · Physics 2015-08-18 A. P. Itin , M. I. Katsnelson

We study the Gutzwiller method for the spinless fermion model in one dimension, which is one of the simplest models that incorporates the intersite Coulomb interaction. The Gutzwiller solution of this model has been studied in the…

Strongly Correlated Electrons · Physics 2013-07-12 M. Sherafati , S. Satpathy , D. Pettey