On the predictability of chemical kinetics for the description of the combustion of simple fuels

Autor: Elder M. Mendoza Orbegoso, Luís Fernando Figueira da Silva, André R. Novgorodcev Junior
Přispěvatelé: Pontifícia Universidade Católica do Rio de Janeiro (PUC-Rio)
Rok vydání: 2011
Předmět:
Work (thermodynamics)
Hydrogen
020209 energy
Physical system
Aerospace Engineering
chemistry.chemical_element
Thermodynamics
02 engineering and technology
Combustion
7. Clean energy
Liquefied petroleum gas
Industrial and Manufacturing Engineering
Methane
chemistry.chemical_compound
020401 chemical engineering
Natural gas
0202 electrical engineering
electronic engineering
information engineering

detailed kinetic mechanisms
0204 chemical engineering
Process engineering
ComputingMilieux_MISCELLANEOUS
business.industry
[SPI.FLUID]Engineering Sciences [physics]/Reactive fluid environment
Mechanical Engineering
Applied Mathematics
General Engineering
Laminar flow
natural gas
chemistry
13. Climate action
hydrogen
Automotive Engineering
Environmental science
ethanol
business
liquefied petroleum gas
Zdroj: Journal of the Brazilian Society of Mechanical Sciences and Engineering v.33 n.4 2011
Journal of the Brazilian Society of Mechanical Sciences and Engineering
Associação Brasileira de Engenharia e Ciências Mecânicas (ABCM)
instacron:ABCM
Journal of the Brazilian Society of Mechanical Sciences and Engineering, Volume: 33, Issue: 4, Pages: 492-505, Published: DEC 2011
Journal of the Brazilian Society of Mechanical Sciences and Engineering, Springer Verlag, 2011, 33 (4), pp.492-505. ⟨10.1590/S1678-58782011000400013⟩
ISSN: 1678-5878
1806-3691
DOI: 10.1590/s1678-58782011000400013
Popis: This work presents a systematic comparison between several detailed chemical kinetic models recently developed and available experimental data. The aim is to assess the predictive capabilities of the combustion with air of the following fuels: hydrogen, methane, ethanol and liquefied petroleum gas, in a large range of equivalence ratio. The prevailing thermodynamical conditions range from ambient to the more stringent ones, such as high pressure combustion. In order to assess the predictive performance of the twelve chosen chemical kinetics models, the results of numerical simulations are compared with existing experimental data of the combustion process in two simplified physical systems: the perfectly stirred reactor and the freely propagating premixed laminar flame. When ambient conditions are considered, the comparisons reveal a good agreement among most of detailed kinetic mechanisms, on the prediction of thermochemical properties of practical interest with respect to the corresponding experimental data only, as far as lighter fuels such as hydrogen, methane and ethanol are considered. The chosen mechanisms are shown to meet with di fficulties when mixtures of liquefied petroleum gas and air are considered, even in ambient conditions. The obtained results highlight the necessity for (i) updating the existing mechanisms with the use of recent experimental results and (ii) the development of new comprehensive models. Keywords: detailed kinetic mechanisms, hydrogen, natural gas, ethanol, liquefied petroleum gas
Databáze: OpenAIRE