Kinetics parameter optimization of hydrocarbon fuels via neural ordinary differential equations

X Su, W Ji, J An, Z Ren, S Deng, CK Law - Combustion and Flame, 2023 - Elsevier
Chemical kinetics mechanisms are essential for understanding, analyzing, and simulating
complex combustion phenomena. In this study, a neural ordinary differential equation …

Automatic validation and analysis of predictive models by means of big data and data science

E Ramalli, T Dinelli, A Nobili, A Stagni, B Pernici… - Chemical Engineering …, 2023 - Elsevier
Validation is an essential procedure in the development of a predictive model in several
engineering fields. In addition, recent data analysis techniques and the increasing …

Bayesian calibration of a methane-air global scheme and uncertainty propagation to flame-vortex interactions

JM Armengol, O Le Maitre, R Vicquelin - Combustion and Flame, 2021 - Elsevier
Simplified chemistry models are commonly used in reactive computational fluid dynamics
(CFD) simulations to alleviate the computational cost. Uncertainties associated with the …

Uncertainty quantification and data consistency analysis for the development of hydrogen and syngas oxidation model

H Wang, G Huang, N Aizhan, O Haidn… - International Journal of …, 2024 - Elsevier
The exponential growth of contemporary chemical kinetics data coupled with the potential
inherent high uncertainty poses significant challenges for developing chemical kinetic …

Hybrid Algorithm for Development of Reduced Skeletal Kinetic Mechanisms with Specific Species Targeting

AB Zarch, K Mazaheri, M Khademorezaeian - ACS omega, 2024 - ACS Publications
A novel algorithm is introduced to reduce the number of detailed kinetic mechanisms. The
algorithm uniquely employs a classification of species and a defined parameter that …

Does a reduced model reproduce the uncertainty of the original full-size model?

Z Liu, W Li, J Oreluk, A Hegde, A Packard… - Combustion and …, 2021 - Elsevier
The present study addresses the title question by taking a detailed mechanism of a concrete
combustion system, syngas ignition, deriving from it three reduced models with different …

A shock-tube and modeling study of syngas ignition delay times in rich CO2 environment at elevated pressures

W Li, C Zou, H Yao - Combustion and Flame, 2023 - Elsevier
Oxy-fuel combustion techniques are crucial for fossil fuel power plants with substantially
reduced greenhouse gas emission. The chemical effect of CO 2 as a reactant/product or a …

Bayesian Inference and Experimental Design of Combustion Kinetic Models

H Chen - 2024 - dspace.mit.edu
In combustion kinetic model calibration, researchers usually use experimental data to
reduce the uncertainty of kinetic parameters, and Bayesian inference is the most common …

[图书][B] Quantifying the agreement between computational models and experimental data under uncertainty

AS Hegde - 2020 - search.proquest.com
Bound-to-bound data collaboration (abbreviated B2BDC) is a deterministic optimization-
based approach for uncertainty quantification. The framework combines models and data …

[PDF][PDF] A Complete Bibliography of Publications in SIAM slash ASA Journal on Uncertainty Quantification

NHF Beebe - 2024 - 155.101.98.136
CHKP19, DMS23, Dia23, DY21, EFF+23, ESS15, EDA23, GP18, GBC+14, GGS23, GG24,
GP24, GK19, HS21, HSAY20, HQS21, HN17, Hos17, HKZ18a, HKZ18b, KLLU19, KBS13 …