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Employing a classical density-functional description of liquid environments, we introduce a rigorous method for the diffusion quantum Monte Carlo calculation of free energies and thermodynamic averages of solvated systems that requires…

A model recently introduced for diluted magnetic semiconductors by Berciu and Bhatt (PRL 87, 107203 (2001)) is studied with a Monte Carlo technique, and the results are compared to Hartree-Fock calculations. For doping rates close to the…

Disordered Systems and Neural Networks · Physics 2009-11-07 Matthias Mayr , Gonzalo Alvarez , Elbio Dagotto

By considering the appropriate finite-size effect, we explain the connection between Monte Carlo simulations of two-dimensional anisotropic Heisenberg antiferromagnet in a field and the early renormalization group calculation for the…

Statistical Mechanics · Physics 2009-11-11 Chenggang Zhou , D. P. Landau , Thomas C. Schulthess

We investigate the ferromagnetic Kondo-lattice model (FKLM) with a correlated conduction band. A moment conserving approach is proposed to determine the electronic self-energy. Mapping the interaction onto an effective Heisenberg model we…

Strongly Correlated Electrons · Physics 2015-06-24 J. Kienert , C. Santos , W. Nolting

We construct asymptotic arguments for the relative efficiency of rejection-free Monte Carlo (MC) methods compared to the standard MC method. We find that the efficiency is proportional to $\exp{({const} \beta)}$ in the Ising, $\sqrt{\beta}$…

Statistical Mechanics · Physics 2009-11-11 H. Watanabe , S. Yukawa , M. A. Novotny , N. Ito

Monte Carlo is one of the most useful methods to study the quantum Hall problems. In this paper, we introduce a fast lattice Monte Carlo method based on a mathematically exact reformulation of the torus quantum Hall problems from continuum…

Strongly Correlated Electrons · Physics 2019-03-27 Jie Wang , Scott D. Geraedts , E. H. Rezayi , F. D. M. Haldane

We investigate the effects of magnetic inhomogeneities and thermal fluctuations on the magnetic properties of a rare earth intermetallic compound, Nd$_2$Fe$_{14}$B. The constrained Monte Carlo method is applied to a Nd$_2$Fe$_{14}$B bulk…

We use a quantum Monte Carlo method (stochastic series expansion) to study the effects of a magnetic or nonmagnetic impurity on the magnetic susceptibility of the two-dimensional Heisenberg antiferromagnet. At low temperatures, we find a…

Strongly Correlated Electrons · Physics 2009-11-10 Kaj H. Hoglund , Anders W. Sandvik

We develop a nonequilibrium increment method in quantum Monte Carlo simulations to obtain the R\'enyi entanglement entropy of various quantum many-body systems with high efficiency and precision. To demonstrate its power, we show the…

Strongly Correlated Electrons · Physics 2022-07-01 Jiarui Zhao , Bin-Bin Chen , Yan-Cheng Wang , Zheng Yan , Meng Cheng , Zi Yang Meng

Motivated by potential realizations in cold-atom or cold-molecule systems, we have performed quantum Monte Carlo simulations of two-component gases of fermions in two dimensions with hard-core interactions. We have determined the gross…

Quantum Gases · Physics 2011-05-19 N. D. Drummond , N. R. Cooper , R. J. Needs , G. V. Shlyapnikov

While recent work towards the development of tight-binding and ab-initio algorithms has focused on molecular dynamics, Monte Carlo methods can often lead to better results with relatively little effort. We present here a multi-step Monte…

Statistical Mechanics · Physics 2009-10-31 Parthapratim Biswas , G. T. Barkema , Normand Mousseau , W. F. van der Weg

Dynamic relaxation of the XY model quenched from a high temperature state to the critical temperature or below is investigated with Monte Carlo methods. When a non-zero initial magnetization is given, in the short-time regime of the dynamic…

Condensed Matter · Physics 2009-10-30 K. Okano , L. Schuelke , K. Yamagishi , B. Zheng

Here, a dynamical Monte-Carlo (DMC) method is used to study temperature-dependent dynamical magnetization of famous Mn2Ni system as typical example of single-chain magnets with strong magnetic anisotropy. Simulated magnetization curves are…

Mesoscale and Nanoscale Physics · Physics 2015-05-21 Jun Li , Bang-Gui Liu

We find evidence for decaying magnons at strong magnetic field in the square lattice spin-1/2 Heisenberg antiferromagnet. The results are obtained using Quantum Monte Carlo simulations combined with a Bayesian inference technique to obtain…

Strongly Correlated Electrons · Physics 2008-11-19 Olav F. Syljuasen

We propose a new quantum Monte Carlo algorithm which realizes a relaxation intrinsic to the original quantum system. The Monte Carlo dynamics satisfies the dynamic scaling relation $\tau\sim \xi^z$ and is independent of the Trotter number.…

Statistical Mechanics · Physics 2009-11-10 Tota Nakamura , Yoshiyuki Ito

We investigate a one-dimensional S=1/2 antiferromagnetic Heisenberg model coupled to quantum lattice vibration using a quantum Monte Carlo method. We study the ground-state lattice fluctuation where the system shows a characteristic…

Statistical Mechanics · Physics 2009-11-07 Hiroaki Onishi , Seiji Miyashita

The magnetization process of the spin-1/2 antiferromagnetic Heisenberg model on two-dimensional square-kagome lattice is studied theoretically. The metamagnetic jumps exist in the magnetization process at the higher edge of the 1/3 and 2/3…

Strongly Correlated Electrons · Physics 2018-07-06 Yasumasa Hasegawa , Hiroki Nakano , Toru Sakai

We study the superconducting Kosterlitz-Thouless transition of the attractive Hubbard model on a two-dimensional triangular lattice using auxiliary field quantum Monte Carlo method for system sizes up to $12\times 12$ sites. Combining three…

Strongly Correlated Electrons · Physics 2009-11-11 Tsuguhito Nakano , Kazuhiko Kuroki

In a recent Letter we introduced Hellmann-Feynman operator sampling in diffusion Monte Carlo calculations. Here we derive, by evaluating the second derivative of the total energy, an efficient method for the calculation of the static…

Other Condensed Matter · Physics 2015-05-13 R. Gaudoin , J. M. Pitarke

The three-dimensional XY model is investigated in the presence of a uniform magnetic field applied in the $X$-direction. The nearest neighbour intraplanar interaction is considered ferromagnetic, and the interplanar nearest neighbour…

Statistical Mechanics · Physics 2022-08-30 Muktish Acharyya , Erol Vatansever