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In this paper we establish a new efficient method for simulating polymer-solvent systems which combines a lattice Boltzmann approach for the fluid with a continuum molecular dynamics (MD) model for the polymer chain. The two parts are…

Soft Condensed Matter · Physics 2009-10-31 Patrick Ahlrichs , Burkhard Duenweg

We present a new hybrid lattice-Boltzmann and Langevin molecular dynamics scheme for simulating the dynamics of suspensions of spherical colloidal particles. The solvent is modeled on the level of the lattice-Boltzmann method while the…

Soft Condensed Matter · Physics 2007-06-20 Vladimir Lobaskin , Burkhard Duenweg

The recent development of the lattice gas automata method and its extension to the lattice Boltzmann method have provided new computational schemes for solving a variety of partial differential equations and modeling chemically reacting…

comp-gas · Physics 2008-02-03 S. Chen , S. P. Dawson , G. D. Doolen , D. R. Janecky , A. Lawniczak

We propose a new model suitable for a nonequilibrium molecular dynamics (MD) simulation of electrical conductors. The model consists of classical electrons and atoms. The atoms compose a lattice vibration system. The electrons are scattered…

Statistical Mechanics · Physics 2015-05-30 Fan Lee , Tatsuro Yuge , Akira Shimizu

A four-way coupling scheme for the direct numerical simulation of particle-laden flows is developed and analyzed. It employs a novel adaptive multi-relaxation time lattice Boltzmann method to simulate the fluid phase efficiently. The…

Computational Physics · Physics 2020-03-04 Christoph Rettinger , Ulrich Rüde

The simulation of geometrically resolved rigid particles in a fluid relies on coupling algorithms to transfer momentum both ways between the particles and the fluid. In this article, the fluid flow is modeled with a parallel Lattice…

Fluid Dynamics · Physics 2021-03-22 Lukas Werner , Christoph Rettinger , Ulrich Rüde

Building upon the Integer Lattice Gas Automata framework of Blommel \textit{et al.} \cite{PhysRevE.97.023310}, we introduce a simplified, fluctuation-free variant. This approach relies on floating-point numbers and closely mirrors the…

A new lattice Boltzmann (LB) model is introduced, based on a regularization of the pre-collision distribution functions in terms of the local density, velocity, and momentum flux tensor. The model dramatically improves the precision and…

Fluid Dynamics · Physics 2007-05-23 Jonas Latt , Bastien Chopard

The paper presents a solution to the Boltzmann kinetic equation based on the construction of its discrete conservative model. Discrete analogue of the collision integral is presented as a contraction of a tensor, which is independent from…

Statistical Mechanics · Physics 2017-07-04 George Arabuli

We are examining a new kind of lattice gas that closely resembles modern lattice Boltzmann methods. This new kind of lattice gas, that we call a Monte Carlo Lattice Gas, has interesting properties that shed light on the origin of the…

Computational Physics · Physics 2018-02-28 Thomas Blommel , Alexander J. Wagner

We propose two lattice models in one dimension, with stochastically hopping particles which aggregate on contact. The hops are guided by "velocity rates" which themselves evolve according to the rules of ballistic aggregation as in a sticky…

Statistical Mechanics · Physics 2011-03-01 Supravat Dey , Dibyendu Das , R. Rajesh

We develop a mesoscopic lattice Boltzmann model for liquid-vapor phase transition by handling the microscopic molecular interaction. The short-range molecular interaction is incorporated by recovering an equation of state for dense gases,…

Fluid Dynamics · Physics 2021-06-30 Rongzong Huang , Huiying Wu , Nikolaus A. Adams

We present fully nonlinear dissipative fluid dynamics simulations of a trapped two-dimensional Fermi gas at unitarity using a Lattice Boltzmann algorithm. We are able to simulate non-harmonic trapping potentials, temperature-dependent…

Quantum Gases · Physics 2016-01-27 Jasmine Brewer , Miller Mendoza , Ryan E. Young , Paul Romatschke

The birth of the lattice Boltzmann method (LBM) fulfils a dream that simple arithmetic calculations can simulate complex fluid flows without solving complicated partial differential flow equations. Its power and potential of resolving more…

Computational Engineering, Finance, and Science · Computer Science 2019-01-10 Jian Guo Zhou

We introduce a lattice Boltzmann for simulating an immiscible binary fluid mixture. Our collision rules are derived from a macroscopic thermodynamic description of the fluid in a way motivated by the Cahn-Hilliard approach to…

comp-gas · Physics 2009-10-28 Enzo Orlandini , Michael R. Swift , J. M. Yeomans

We report on a lattice based algorithm, completely vectorized for molecular dynamics simulations. Its algorithmic complexity is of the order $O(N)$, where $N$ is the number of particles. The algorithm works very effectively when the…

comp-gas · Physics 2019-06-05 V. Buchholtz , T. Pöschel

We present a comparative study of two computer simulation methods to obtain static and dynamic properties of dilute polymer solutions. The first approach is a recently established hybrid algorithm based upon dissipative coupling between…

Soft Condensed Matter · Physics 2020-07-03 Tri T. Pham , Ulf D. Schiller , J. Ravi Prakash , Burkhard Duenweg

We report on a lattice based algorithm, completely vectorized for molecular dynamics simulations. Its algorithmic complexity is of the order O(N), where $N$ is the number of particles. The algorithm works very effectively when the particles…

Condensed Matter · Physics 2009-10-22 V. Buchholtz , T. Poeschel

Simulating plasmas in the Hall-MagnetoHydroDynamics (Hall-MHD) regime represents a valuable {approach for the investigation of} complex non-linear dynamics developing in astrophysical {frameworks} and {fusion machines}. Taking into account…

We present the efficient and universal numerical method for simulation of interacting quantum gas kinetics on a finite momentum lattice, based on the Boltzmann equation for occupation numbers. Usually, the study of models with two-particle…

Mesoscale and Nanoscale Physics · Physics 2023-05-15 I. O. Kuznetsov , P. F. Kartsev