Machine learning for integrating combustion chemistry in numerical simulations

Autor: Phuc-Danh Nguyen, Pascale Domingo, Luc Vervisch, Huu-Tri Nguyen
Přispěvatelé: Complexe de recherche interprofessionnel en aérothermochimie (CORIA), Université de Rouen Normandie (UNIROUEN), Normandie Université (NU)-Normandie Université (NU)-Institut national des sciences appliquées Rouen Normandie (INSA Rouen Normandie), Institut National des Sciences Appliquées (INSA)-Normandie Université (NU)-Institut National des Sciences Appliquées (INSA)-Centre National de la Recherche Scientifique (CNRS), ArcelorMittal Maizières Research SA, ArcelorMittal
Jazyk: angličtina
Rok vydání: 2021
Předmět:
Artificial neural network
Degrees of freedom (statistics)
Principal component analysis
02 engineering and technology
Machine learning
computer.software_genre
Combustion
01 natural sciences
7. Clean energy
010305 fluids & plasmas
Reduction (complexity)
[SPI]Engineering Sciences [physics]
QA76.75-76.765
Combustion chemistry
0203 mechanical engineering
Artificial Intelligence
0103 physical sciences
Decomposition (computer science)
Computer software
Physics::Chemical Physics
Engineering (miscellaneous)
ComputingMilieux_MISCELLANEOUS
Partial differential equation
Chemistry reduction
Computer simulation
business.industry
k-means clustering
TK1-9971
020303 mechanical engineering & transports
General Energy
Micro-mixing modeling
Artificial intelligence
Electrical engineering. Electronics. Nuclear engineering
business
computer
Zdroj: Energy and AI, Vol 5, Iss, Pp 100082-(2021)
Energy and AI
Energy and AI, 2021, 5, pp.100082. ⟨10.1016/j.egyai.2021.100082⟩
ISSN: 2666-5468
DOI: 10.1016/j.egyai.2021.100082⟩
Popis: A strategy based on machine learning is discussed to close the gap between the detailed description of combustion chemistry and the numerical simulation of combustion systems. Indeed, the partial differential equations describing chemical kinetics are stiff and involve many degrees of freedom, making their solving in three-dimensional unsteady simulations very challenging. It is discussed in this work how a reduction of the computing cost by an order of magnitude can be achieved using a set of neural networks trained for solving chemistry. The thermochemical database used for training is composed of time evolutions of stochastic particles carrying chemical species mass fractions and temperature according to a turbulent micro-mixing problem coupled with complex chemistry. The novelty of the work lies in the decomposition of the thermochemical hyperspace into clusters to facilitate the training of neural networks. This decomposition is performed with the Kmeans algorithm, a local principal component analysis is then applied to every cluster. This new methodology for combustion chemistry reduction is tested under conditions representative of a non-premixed syngas oxy-flame.
Databáze: OpenAIRE