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An accurate algorithm is proposed to improve the prediction of a particle in collision with a moving wall within the direct simulation Monte Carlo (DSMC) framework for the simulation of unsteady rarefied flows. This algorithm is able to…

Computational Physics · Physics 2021-09-29 He Zhang , Fanli Shan , Hong Fang , Xing Zhang , Jun Zhang , Jinghua Sun

A grid-free variant of the Direct Simulation Monte Carlo (DSMC) method is proposed, named the Isotropic DSMC (I-DSMC) method, that is suitable for simulating dense fluid flows at molecular scales. The I-DSMC algorithm eliminates all grid…

Statistical Mechanics · Physics 2015-05-13 A. Donev , B. J. Alder , A. L. Garcia

We formulate low Mach number fluctuating hydrodynamic equations appropriate for modeling diffusive mixing in isothermal mixtures of fluids with different density and transport coefficients. These equations eliminate the fluctuations in…

Numerical Analysis · Mathematics 2016-01-20 A. Donev , A. J. Nonaka , Y. Sun , T. G. Fai , A. L. Garcia , J. B. Bell

We study the formation and the dynamics of correlations in the velocity field for 1D and 2D cooling granular gases with the assumption of negligible density fluctuations (``Homogeneous Velocity-correlated Cooling State'', HVCS). It is shown…

Statistical Mechanics · Physics 2015-06-24 Andrea Baldassarri , Umberto Marini Bettolo Marconi , Andrea Puglisi

A macroscopic mesoscopic, deterministic stochastic coupling strategy is proposed to accelerate the direct simulation Monte Carlo (DSMC) method for chemical reaction. First, a macroscopic synthetic equation is formulated by integrating…

Computational Physics · Physics 2026-05-14 Hong Deng , Liyan Luo , Lei Wu

We revisit two basic Direct Simulation Monte Carlo Methods to model aggregation kinetics and extend them for aggregation processes with collisional fragmentation (shattering). We test the performance and accuracy of the extended methods and…

Numerical Analysis · Mathematics 2022-07-27 A. Kalinov , A. I. Osinsky , S. A. Matveev , W. Otieno , N. V. Brilliantov

A novel multiscale numerical method is developed to accelerate direct simulation Monte Carlo (DSMC) simulations for polyatomic gases with internal energy. This approach applies the general synthetic iterative scheme to stochastic…

Computational Physics · Physics 2025-01-22 Liyan Luo , Tao Huang , Qi Li , Lei Wu

Within the framework of the homogeneous non-linear Boltzmann equation, we present a new analytic method, without the intrinsic limitations of existing methods, for obtaining asymptotic solutions. This method permits extension of existing…

Statistical Mechanics · Physics 2009-11-11 M. H. Ernst , E. Trizac , A. Barrat

The Direct Simulation Monte Carlo (DSMC) method is the gold standard for non-equilibrium rarefied gas dynamics, yet its computational cost can be prohibitive, especially for near-continuum regimes and high-fidelity \emph{ab initio}…

Computational Physics · Physics 2026-02-26 Ehsan Roohi , Ahmad Shoja-Sani , Stefan Stefanov

A multiscale stochastic-deterministic coupling method is proposed to investigate the complex interactions between turbulent and rarefied gas flows within a unified framework. This method intermittently integrates the general synthetic…

Computational Physics · Physics 2025-03-14 Liyan Luo , Songyan Tian , Lei Wu

We present a fluctuating hydrodynamic description of an active lattice gas model with excluded volume interactions that exhibits motility-induced phase separation under appropriate conditions. For quasi-one dimension and higher, stability…

Statistical Mechanics · Physics 2025-10-20 Ritwik Mukherjee , Soumyabrata Saha , Tridib Sadhu , Abhishek Dhar , Sanjib Sabhapandit

In this study, we investigate the behaviour of sedimenting solid particles and the influence of microscopic particle dynamics on the collective motion of a sedimenting cloud. Departing from conventional direct numerical simulations (DNS),…

Fluid Dynamics · Physics 2025-10-28 Nejc Vovk , Jana Wedel , Paul Steinmann , Jure Ravnik

First of all, this paper presents some improvements of DSMC method in the form of new schemes and approaches, that, for a wide class of problems, increase performance and reduce the demands on computer resources. The most important…

Fluid Dynamics · Physics 2012-01-16 Roman V. Maltsev

The direct simulation Monte Carlo (DSMC) method is a widely used stochastic particle approach to solving the Boltzmann equation. However, its computational cost remains a major drawback, which can be attributed to statistical errors when…

Fluid Dynamics · Physics 2024-07-12 Takehiro Shiraishi , Ikuya Kinefuchi

It is known that a finite-size homogeneous granular fluid develops an hydrodynamic-like instability when dissipation crosses a threshold value. This instability is analyzed in terms of modified hydrodynamic equations: first, a source term…

Statistical Mechanics · Physics 2009-10-31 R. Soto , M. Mareschal , M. Malek Mansour

The small magnitude and long-range character of non-covalent interactions pose a significant challenge for computational quantum chemical and electronic-structure methods alike. State-of-the-art coupled cluster (CC) theory and…

Chemical Physics · Physics 2026-01-22 S. Lambie , P. López-Ríos , D. Kats , Ali Alavi

We present in this work results from numerical solutions, obtained by means of the direct simulation Monte Carlo (DSMC) method, of the Boltzmann and Boltzmann--Lorentz equations for an impurity immersed in a granular gas under planar…

Soft Condensed Matter · Physics 2011-07-14 F Vega Reyes , A Santos , V Garzó

Recent studies on diffusion-based sampling methods have shown that Langevin Monte Carlo (LMC) algorithms can be beneficial for non-convex optimization, and rigorous theoretical guarantees have been proven for both asymptotic and finite-time…

Optimization and Control · Mathematics 2019-01-23 Thanh Huy Nguyen , Umut Şimşekli , Gaël Richard

We present a lattice Monte Carlo algorithm based on the one originally proposed by Maggs and Rossetto for simulating electrostatic interactions in inhomogeneous dielectric media. The original algorithm is known to produce attractive…

Soft Condensed Matter · Physics 2017-05-12 Xiaozheng Duan , Issei Nakamura , Zhen-Gang Wang

Monte Carlo simulation provides a powerful tool for understanding and exploring thermodynamic phase equilibria in many-particle interacting systems. Among the most physically intuitive simulation methods is Gibbs ensemble Monte Carlo…

Statistical Mechanics · Physics 2015-06-12 Alan R. Denton , Michael P. Schmidt