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The inadequate mixing of conventional Markov Chain Monte Carlo (MCMC) methods for multi-modal distributions presents a significant challenge in practical applications such as Bayesian inference and molecular dynamics. Addressing this, we…

Machine Learning · Statistics 2024-05-30 Wenlin Chen , Mingtian Zhang , Brooks Paige , José Miguel Hernández-Lobato , David Barber

Many modern production and measurement facilities incorporate multiphase systems at low pressures. In this region of flows at small, non-zero Knudsen- and low Mach numbers the classical mesoscopic Monte Carlo methods become increasingly…

Fluid Dynamics · Physics 2015-09-10 S. Schmieschek , D. K. N. Sinz , F. Keller , U. Nieken , J. Harting

This study presents a deep neural network (DNN) framework that accelerates Direct Simulation Monte Carlo (DSMC) computations for rarefied-gas flows, while maintaining high physical fidelity. First, a fully connected deep neural network is…

Computational Physics · Physics 2025-07-01 Ehsan Roohi , Ahmad Shoja-sani

The Direct Simulation Monte Carlo (DSMC) method remains the gold standard for simulating rarefied gas flows but is prohibitively expensive for parametric and many-query applications. To address this limitation, we introduce a Deep Operator…

Fluid Dynamics · Physics 2025-09-23 Ehsan Roohi , Amirmehran Mahdavi

The recently-developed general synthetic iterative scheme (GSIS) is efficient in simulating multiscale rarefied gas flows due to the coupling of mesoscopic kinetic equation and macroscopic synthetic equation: for linearized Poiseuille flow…

Fluid Dynamics · Physics 2023-11-07 Wei Liu , Yanbing Zhang , Jianan Zeng , Lei Wu

Fixed-node diffusion Monte Carlo (DMC) is a stochastic algorithm for finding the lowest energy many-fermion wave function with the same nodal surface as a chosen trial function. It has proved itself among the most accurate methods available…

Condensed Matter · Physics 2009-10-31 W. M. C. Foulkes , Randolph Q. Hood , R. J. Needs

The simulation of rarefied gas flow based on the Boltzmann equation is challenging, especially when the gas mixtures have disparate molecular masses. In this paper, a computationally tractable kinetic model is proposed for monatomic gas…

Fluid Dynamics · Physics 2024-03-12 Qi Li , Jianan Zeng , Lei Wu

The general synthetic iteration scheme (GSIS) is extended to find the steady-state solution of nonlinear gas kinetic equation, removing the long-standing problems of slow convergence and requirement of ultra-fine grids in near-continuum…

Computational Physics · Physics 2021-02-24 Lianhua Zhu , Xingcai Pi , Wei Su , Zhi-Hui Li , Yonghao Zhang , Lei Wu

The recently proposed discrete unified gas kinetic scheme (DUGKS) is a finite volume method for deterministic solution of the Boltzmann model equation with asymptotic preserving property. In DUGKS, the numerical flux of the distribution…

Fluid Dynamics · Physics 2015-03-26 Lianhua Zhu , Zhaoli Guo , Kun Xu

This paper is a continuation of our earlier work [Z.L. Guo {\it et al.}, Phys. Rev. E {\bf 88}, 033305 (2013)] where a multiscale numerical scheme based on kinetic model was developed for low speed isothermal flows with arbitrary Knudsen…

Fluid Dynamics · Physics 2015-06-22 Zhaoli Guo , Ruijie Wang , Kun Xu

A novel approach called Moate Simulation is presented to provide an accurate numerical evolution of probability distribution functions represented on grids arising from stochastic differential processes where initial conditions are…

Computational Finance · Quantitative Finance 2022-12-19 Michael E. Mura

Advanced algorithms are necessary to obtain faster-than-real-time dynamic simulations in a number of different physical problems that are characterized by widely disparate time scales. Recent advanced dynamic Monte Carlo algorithms that…

Materials Science · Physics 2016-11-23 M. A. Novotny

Multiscale rarefied gas flows with moving boundaries pose significant challenges to the numerical simulation, where the primary difficulties involve robustly managing the mesh movement and ensuring computational efficiency across all flow…

Computational Physics · Physics 2024-08-20 Jianan Zeng , Yanbing Zhang , Lei Wu

Plasmonic nanostructures significantly improve the performance of photoconductive devices (PCDs) in generating terahertz radiation. However, they are geometrically intricate and result in complicated electromagnetic (EM) field and carrier…

Numerical Analysis · Mathematics 2020-10-14 Liang Chen , Hakan Bagci

Atomistic simulations provide valuable insights into the physical processes governing material behavior. However, their applicability is fundamentally constrained by the limited time scales accessible to brute-force simulations. This…

Computational Physics · Physics 2026-02-16 Michael Kim , Wei Cai

The stochastic simulation algorithm (SSA) and the corresponding Monte Carlo (MC) method are among the most common approaches for studying stochastic processes. They rely on knowledge of interevent probability density functions (PDFs) and on…

Computation · Statistics 2024-02-12 S. Rusconi , E. Akhmatskaya , D. Sokolovski , N. Ballard , J. C. de la Cal

In the study of rarefied gas dynamics, the discrete velocity method (DVM) has been widely employed to solve the gas kinetic equations. Although various versions of DVM have been developed, their performance, in terms of accuracy and…

Fluid Dynamics · Physics 2016-12-21 Peng Wang , Minh-Tuan Ho , Lei Wu , Zhaoli Guo , Yonghao Zhang

We present a study of single-mode Rayleigh-Taylor instabilities (smRTI) with a modified Direct Simulation Monte Carlo (mDSMC) code in two dimensions. The mDSMC code is aimed to capture the dynamics of matter for a large range of Knudsen…

Fluid Dynamics · Physics 2016-11-15 Irina Sagert , Jim Howell , Alec Staber , Terrance Strother , Dirk Colbry , Wolfgang Bauer

Colloids have a striking relevance in a wide spectrum of industrial formulations, spanning from personal care products to protective paints. Their behaviour can be easily influenced by extremely weak forces, which disturb their…

Soft Condensed Matter · Physics 2018-06-14 Daniel Corbett , Alejandro Cuetos , Matthew Dennison , Alessandro Patti

A double-distribution-function based lattice Boltzmann method (DDF-LBM) is proposed for the simulation of polyatomic gases in the supersonic regime. The model relies on an extended equilibrium state that is constructed to reproduce the…

Computational Physics · Physics 2020-02-13 Jonas Latt , Christophe Coreixas , Joel Beny , Andrea Parmigiani
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