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相关论文: Chemical-Diffusive Models for Flame Acceleration a…

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This paper presents an efficient method based on Evolutionary Center Algorithm (ECA) for accurately and efficiently determining the optimal reaction and diffusion parameters for Chemical-Diffusive Models (CDM) to simulate flame acceleration…

化学物理 · 物理学 2026-04-23 Huahua Xiao , Xu Zhang , Mingbin Zhao , Congling Shi

Different simplified and detailed chemical models and their impact on simulations of combustion regimes initiating by the initial temperature gradient in methane/air mixtures are studied. The limits of the regimes of reaction wave…

化学物理 · 物理学 2018-11-20 Cheng Wang , Chengeng Qian , JianNan Liu , Mikhail A. Liberman

In the present work we compare reliability of several most widely used reduced detailed chemical kinetic schemes for hydrogen-air and hydrogen-oxygen combustible mixtures. The validation of the schemes includes detailed analysis of 0D and…

流体动力学 · 物理学 2013-12-13 M. F. Ivanov , A. D. Kiverin , M. A. Liberman , A. E Smygalina

Understanding the mechanisms of explosions is important for minimizing devastating hazards. Due to the complexity of real chemistry, a single-step reaction mechanism is usually used for theoretical and numerical studies. The purpose of this…

化学物理 · 物理学 2019-07-24 Mikhail Liberman , Cheng Wang , Chengeng Qian , JianNan Liu

In the current study, the influence of turbulent mixing and local reaction rates on deflagration to detonation transition (DDT) was investigated using a state-of-the-art large eddy simulation (LES) strategy. Specifically, detonation…

流体动力学 · 物理学 2017-08-10 Brian Maxwell , Andrzej Pekalski , Matei Radulescu

A local-sensitivity-analysis technique is employed to generate new skeletal reaction models for methane combustion from the foundational fuel chemistry model (FFCM-1). The sensitivities of the thermo-chemical variables with respect to the…

化学物理 · 物理学 2023-08-30 Yinmin Liu , Hessam Babaee , Peyman Givi , Harsha Chelliah , Daniel Livescu , Arash Nouri

The mechanisms of direct detonation initiation (DDI) in methane/air mixtures containing coal particles are investigated through simulations conducted using the Eulerian-Lagrangian method in a two-dimensional configuration. Methane-air…

化学物理 · 物理学 2025-03-05 Shengnan Li , Shangpeng Li , Shumeng Xie , Yong Xu , Ke Gao , Huangwei Zhang

We present direct numerical simulations demonstrating deflagration-to-detonation transition (DDT) driven by oxygen flames in Type Ia supernova progenitors. Using the Castro hydrodynamics code coupled with the ``aprox13'' 13-isotope nuclear…

高能天体物理现象 · 物理学 2025-10-31 Xiaoyu Zhang , Lile Wang , Yang Gao , Yao Zhou

A deep learning-based model reduction (DeePMR) method for simplifying chemical kinetics is proposed and validated using high-temperature auto-ignitions, perfectly stirred reactors (PSR), and one-dimensional freely propagating flames of…

机器学习 · 计算机科学 2022-09-09 Zhiwei Wang , Yaoyu Zhang , Enhan Zhao , Yiguang Ju , Weinan E , Zhi-Qin John Xu , Tianhan Zhang

The space-time adaptive ADER-DG finite element method with LST-DG predictor and a posteriori sub-cell ADER-WENO finite-volume limiting was used for simulation of multidimensional reacting flows with detonation waves. The presented numerical…

流体动力学 · 物理学 2024-09-23 I. S. Popov

Developing efficient and accurate algorithms for chemistry integration is a challenging task due to its strong stiffness and high dimensionality. The current work presents a deep learning-based numerical method called DeepCombustion0.0 to…

化学物理 · 物理学 2020-12-24 Tianhan Zhang , Yaoyu Zhang , Weinan E , Yiguang Ju

The application of deep neural networks (DNNs) holds considerable promise as a substitute for the direct integration of chemical source terms in combustion simulations. However, challenges persist in ensuring high precision and…

流体动力学 · 物理学 2023-12-29 Han Li , Ruixin Yang , Min Zhang , Runze Mao , Zhi X. Chen

We study experimentally fast flames and their transition to detonation in mixtures of methane, ethane, ethylene, acetylene, and propane mixtures with oxygen. Following the interaction of a detonation wave with a column of cylinders of…

流体动力学 · 物理学 2015-12-09 Mohamed Saif , Wentian Wang , Andrzej Pekalski , Marc Levin , Matei I. Radulescu

Accurate and efficient numerical simulation of ammonia combustion is critical for advancing ammonia-based energy systems, where turbulent flame dynamics and pollutant formation strongly affect practical applicability. However, such…

流体动力学 · 物理学 2025-09-26 Ke Xiao , Yangchen Xu , Han Li , Zhi X. Chen

A combustion chemistry acceleration scheme is developed based on deep operator networks (DeepONets). The scheme is based on the identification of combustion reaction dynamics through a modified DeepOnet architecture such that the solutions…

化学物理 · 物理学 2023-04-25 Anuj Kumar , Tarek Echekki

Ammonia is a promising zero-carbon fuel for industrial and transport applications, but its combustion is hindered by flame instabilities, incomplete oxidation, and the formation of nitrogen oxides. Accurate and detailed kinetic models are…

A novel, data-driven model of deflagration-to-detonationtransition (DDT) is constructed for application to explosions of thermonuclear supernovae (SN Ia). The DDT mechanism has been suggested as the necessary physics process to obtain…

太阳与恒星天体物理 · 物理学 2024-01-31 Brandon L. Gusto

Denoising Diffusion Probabilistic Models (DDPMs) are a very popular class of deep generative model that have been successfully applied to a diverse range of problems including image and video generation, protein and material synthesis,…

Chemical kinetics mechanisms are essential for understanding, analyzing, and simulating complex combustion phenomena. In this study, a Neural Ordinary Differential Equation (Neural ODE) framework is employed to optimize kinetics parameters…

化学物理 · 物理学 2022-09-07 Xingyu Su , Weiqi Ji , Jian An , Zhuyin Ren , Sili Deng , Chung K. Law

A one dimensional (1-D), isothermal model for a direct methanol fuel cell (DMFC) is presented. This model accounts for the kinetics of the multi-step methanol oxidation reaction at the anode. Diffusion and crossover of methanol are modeled…

化学物理 · 物理学 2020-03-10 Brenda L. Garcia , Vijay A. Sethuraman , John W. Weidner , Roger Dougal , Ralph E. White
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