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Predicting reaction outcomes across continuous solvent composition ranges remains a critical challenge in organic synthesis and process chemistry. Traditional machine learning approaches often treat solvent identity as a discrete…

Machine Learning · Computer Science 2025-12-23 Hongsheng Xing , Qiuxin Si

The intrinsic uncertainty of fluid properties, including the equation of state, viscosity, and thermal conductivity, on boundary layer stability has scarcely been addressed. When a fluid is operating in the vicinity of the Widom line…

Fluid Dynamics · Physics 2025-02-07 Jie Ren , Yongxiang Wu , Xuerui Mao , Cheng Wang , Markus Kloker

This paper presents a novel methodology for the direct numerical modeling and simulation of turbulent flows. The kinetic model equation is firstly extended to turbulent flow with the account of coupled evolution of kinetic, thermal, and…

Computational Physics · Physics 2025-03-11 Xiaojian Yang , Kun Xu

A hybrid RANS/LES framework is developed based on a recently proposed Improved Delayed Detached Eddy Simulation (IDDES) model combined with a variant of recycling and rescaling method of generating inflow turbulence. This framework was…

Fluid Dynamics · Physics 2014-08-06 Sunil K. Arolla

Accurate prediction of blast pressure fields is essential for applications in structural safety, defense planning, and hazard mitigation. Traditional methods such as empirical models and computational fluid dynamics (CFD) simulations offer…

Machine Learning · Computer Science 2025-05-28 Reid Graves , Anthony Zhou , Amir Barati Farimani

We utilize resolvent and weakly nonlinear analyses in combination with direct numerical simulations (DNS) to identify mechanisms for oblique transition in a Mach 5 hypersonic flow over an adiabatic slender double-wedge. Even though the…

Fluid Dynamics · Physics 2022-09-28 Anubhav Dwivedi , G. S. Sidharth , Mihailo R. Jovanović

Surface patterns on ablating materials are observed in high-speed ground and flight tests, but the mechanisms behind their formation are not known. In this paper, the origin of surface patterns is investigated via a local linear stability…

Fluid Dynamics · Physics 2026-01-14 Blaine Vollmer , Alberto Padovan , Daniel J. Bodony

Transient growth and resolvent analyses are routinely used to assess non-asymptotic properties of fluid flows. In particular, resolvent analysis can be interpreted as a special case of viewing flow dynamics as an open system in which…

Fluid Dynamics · Physics 2020-10-28 Mihailo R. Jovanović

Graph diffusion models achieve state-of-the-art performance in graph generation but suffer from quadratic complexity in the number of nodes -- and much of their capacity is wasted modeling the absence of edges in sparse graphs. Inspired by…

Machine Learning · Computer Science 2026-05-13 Antoine Siraudin , Christopher Morris

Theoretical studies on linear shear instabilities often use simple velocity and density profiles (e.g. constant, piecewise) for obtaining good qualitative and quantitative predictions of the initial disturbances. Furthermore, such simple…

Fluid Dynamics · Physics 2017-09-28 Divyanshu Bhardwaj , Anirban Guha

Many physical systems of interest involve the close interaction of a flow in a domain with complex, time-varying boundaries. Treatment of boundaries of this nature is cumbersome due to the difficulty in explicitly tracking boundaries that…

Fluid Dynamics · Physics 2025-02-25 Emma M. Boyd , Eric Sandall , Maycon Meier , J. Matt Quinlan , Brandon Runnels

While the computation of the boundary-layer thickness is straightforward for canonical equilibrium flows, there are no established definitions for general non-equilibrium flows. In this work, a method is developed based on a local…

Fluid Dynamics · Physics 2021-03-03 Kevin Patrick Griffin , Lin Fu , Parviz Moin

The field of neural rendering has witnessed significant progress with advancements in generative models and differentiable rendering techniques. Though 2D diffusion has achieved success, a unified 3D diffusion pipeline remains unsettled.…

Computer Vision and Pattern Recognition · Computer Science 2025-12-22 Yushi Lan , Fangzhou Hong , Shangchen Zhou , Shuai Yang , Xuyi Meng , Yongwei Chen , Zhaoyang Lyu , Bo Dai , Xingang Pan , Chen Change Loy

While the approximation properties of single-layer Transformer architectures have been studied in recent works, a rigorous theoretical understanding of the multi-layer setting remains limited. In this work, we establish that multi-layer…

Machine Learning · Computer Science 2026-05-19 Penghao Yu , Haotian Jiang , Zeyu Bao , Qianxiao Li

The turbulent boundary layer over a flat plate is computed by direct numerical simulation (DNS) of the incompressible Navier-Stokes equations as a test bed for a synthetic turbulence generator (STG) inflow boundary condition. The inlet…

Fluid Dynamics · Physics 2021-02-15 James R. Wright , Riccardo Balin , John W. Patterson , John A. Evans , Kenneth E. Jansen

In this paper, we have defined and applied a non-ITM to an extended Blasius problem describing a 2D laminar boundary-layer with power-law viscosity for Newtonian fluids. For a particular value of the parameter involved, this problem reduces…

Numerical Analysis · Mathematics 2020-11-19 Riccardo Fazio

In the finite element analysis with fast decoupled time integration scheme for viscoelastic fluid (the Leonov model) flow, we investigate strong nonlinear behavior in 2D creeping contraction flow. The algorithm is applicable in the whole…

Fluid Dynamics · Physics 2011-11-02 Youngdon Kwon

Fluid flow in the transonic regime finds relevance in aerospace engineering, particularly in the design of commercial air transportation vehicles. Computational fluid dynamics models of transonic flow for aerospace applications are…

Fluid Dynamics · Physics 2020-01-14 S. Ashwin Renganathan , Romit Maulik , Vishwas Rao

This paper concerns the structural stability of smooth cylindrically symmetric transonic flows in a concentric cylinder. Both cylindrical and axi-symmetric perturbations are considered. The governing system here is of mixed…

Analysis of PDEs · Mathematics 2021-01-05 Shangkun Weng , Zhouping Xin , Hongwei Yuan

Despite the substantial demand for high-quality, large-area building maps, no established open-source workflow for generating 2D and 3D maps currently exists. This study introduces an automated, open-source workflow for large-scale 2D and…

Computer Vision and Pattern Recognition · Computer Science 2023-08-17 Hunsoo Song , Jinha Jung