相关论文: Machine Learning Assisted Resistive Force Theory f…

We propose a novel integral model describing the motion of curved slender fibers in viscous flow, and develop a numerical method for simulating dynamics of rigid fibers. The model is derived from nonlocal slender body theory (SBT), which…

Slender fibers are ubiquitous in biology, physics, and engineering, with prominent examples including bacterial flagella and cytoskeletal fibers. In this setting, slender body theories (SBTs), which give the resistance on the fiber…

The theorems of density functional theory (DFT) and reduced density matrix functional theory (RDMFT) establish a bijective map between the external potential of a many-body system and its electron density or one-particle reduced density…

Predicting interfacial thermodynamics across molecular and continuum scales remains a central challenge in computational science. Classical density functional theory (cDFT) provides a first-principles route to connect microscopic…

This paper presents a theory to obtain the force per unit length acting on a slender filament with a non-circular cross-section moving in a fluid at low Reynolds number. Using a regular perturbation of the inner solution, we show that the…

Building efficient, accurate and generalizable reduced order models of developed turbulence remains a major challenge. This manuscript approaches this problem by developing a hierarchy of parameterized reduced Lagrangian models for…

We investigate Machine-Learned Force Fields (MLFFs) trained on approximate Density Functional Theory (DFT) and Coupled Cluster (CC) level potential energy surfaces for the carbon diamond and lithium hydride solids. We assess the accuracy…

We develop an improved lattice-Boltzmann numerical scheme to solve magnetohydrodynamic (MHD) equations in the regime of low magnetic Reynolds numbers, grounded on a manifestly Galilean covariant modeling of the Navier-Stokes equations. The…

The thermal conductivity of organic liquids is a vital parameter influencing various industrial and environmental applications, including energy conversion, electronics cooling, and chemical processing. However, atomistic simulation of…

Learning in structured, multi-context, or non-stationary environments involves two orthogonal difficulties. The first is \emph{metric}: once the correct context is known, how hard is prediction within it? This is the domain of Statistical…

Superhydrophobic surfaces (SHSs) have the potential to reduce drag at solid boundaries. However, multiple independent studies have recently shown that small amounts of surfactant, naturally present in the environment, can induce Marangoni…

Deep reinforcement learning (DRL) is employed to develop control strategies for drag reduction in direct numerical simulations (DNS) of turbulent channel flows at high Reynolds numbers. The DRL agent uses near-wall streamwise velocity…

We introduce a reinforcement learning (RL) environment to design and benchmark control strategies aimed at reducing drag in turbulent fluid flows enclosed in a channel. The environment provides a framework for computationally-efficient,…

Stokesian Dynamics (SD) is a numerical framework used for simulating hydrodynamic interactions in particle suspensions at low Reynolds number. It combines far-field approximations with near-field lubrication corrections, offering a balance…

Patterned surfaces with large effective slip lengths, such as super-hydrophobic surfaces containing trapped gas bubbles, have the potential to reduce hydrodynamic drag. Based on lubrication theory, we analyze an approach of a hydrophilic…

We present an efficient deep learning technique for the model reduction of the Navier-Stokes equations for unsteady flow problems. The proposed technique relies on the Convolutional Neural Network (CNN) and the stochastic gradient descent…

Machine learning force fields (MLFFs) are powerful tools for materials modeling, but their performance is often limited by training dataset quality, particularly the lack of rare event configurations. This limitation undermines their…

In this work, we use a tempering-based adaptive particle filter to infer from a partially observed stochastic rotating shallow water (SRSW) model which has been derived using the Stochastic Advection by Lie Transport (SALT) approach. The…

Advancing our understanding of astrophysical turbulence is bottlenecked by the limited resolution of numerical simulations that may not fully sample scales in the inertial range. Machine learning (ML) techniques have demonstrated promise in…

The motion of rigid spherical particles suspended in a low Reynolds number fluid can be related to the forces, torques and stresslets acting upon them by 22 scalar resistance functions, commonly notated $X^A_{11}$, $X^A_{12}$, $Y^A_{11}$,…