Development of an adaptive chemistry model considering micromixing effects

Chemical Engineering Science

Volumn 58, Issue 20, 2003, Pages 4537-4555

  Banerjee, Ipsita ^a   Ierapetritou, Marianthi G ^a  

^a RUTGERS UNIVERSITY   (United States)

Author keywords

Kinetic model reduction; Mathematical modeling; Mixing; Optimization

Indexed keywords

COMBUSTION; COMPUTER SIMULATION; OPTIMIZATION; PROBLEM SOLVING;

COMBUSTION MODELS;

REACTION KINETICS;

KINETICS; MATHEMATICAL MODELING; MIXING; OPTIMIZATION;

EID: 0142094631     PISSN: 00092509     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2509(03)00343-9     Document Type: Article

References (28)

1. Androulakis I.P. Kinetic mechanism reduction based on an integer programming approach A.I.Ch.E. Journal 46 2000 361
2. Bard Y. Nonlinear parameter estimation 1974 Academic Press New York
3. Borghi R. Turbulent combustion modelling Progress in Energy and Combustion Science 14 1988 245
4. Cannon S.M. Brewster B.S. Smoot L.D. Stochastic modeling of co and no premixed methane combustion Combustion and Flame 113 1998 135
5. Chen J.Y. Stochastic modeling of partially stirred reactors Combustion Science and Technology 122 1997 63
6. Correa S.M. Turbulence-chemistry interactions in the intermediate regime of premixed combustion Combustion and Flame 93 1993 41
7. Correa S.M. A direct comparison of pair-exchange and iem models in premixed combustion Combustion and Flame 103 1995 194
8. Curl R.L. Dispersion phase mixing i: Theory and effects in simple reactor A.I.Ch.E. Journal 9 1963 175
9. Dopazo C. Probability density function approach for a turbulent axisymmetric heated jet centerline evolution Physics of Fluids 18 1975 397
10. Edwards K. Edgar T. Manousiouthakis V.I. Kinetic model reduction using genetic algorithm Computers and Chemical Engineering 22 1998 239
11. Edwards K. Edgar T.F. Manousiouthakis V.I. Reaction mechanism simplification using mixed-integer nonlinear programming Computers and Chemical Engineering 24 2000 67
12. Goldberg D.E. Genetic algorithms in search, optimization and machine learning 1989 Addison-Wesley New York
13. Griffiths J.F. Reduced kinetic models and their application to practical combustion systems Progress in Energy and Combustion Science 21 1995 25
14. Hindmarsh A.C. Stepleman R.S., et-al. ODEPACK, A systematized collection of ODE solvers. Scientific Computing 1983 North-Holland Amsterdam
15. Kee, R., Rupley, F., Meeks, E., - Miller, J. A. (1996). CHEMKIN-III: A Fortran chemical kinetics package for the analysis of gas-phase chemical and plasma kinetics. Sandia Report m SAND96-8216.
16. Lam S.H. Goussis D.A. The csp method for simplifying chemical kinetics International Journal of Chemical Kinetics 26 1994 461
17. 2/air oxidation model by a special perturbation method Chemical Engineering Science 52 1997 4317
18. Lovas T. Nilsson D. Mauss F. Automatic reduction procedure for chemical mechanisms applied to premixed methane/air flames Proceedings of the Combustion Institute 28 2000 1809
19. Mass U. Pope S.B. Simplifying chemical kinetics: Intrinsic low dimensional manifold in composition space Combustion and Flame 88 1992 239
20. Michalewicz Z. Schoenauer M. Evolutionary algorithms for constrained parameter optimization problems Evolution and Computers 4 1996 1
21. Peters N. Williams F.A. The asymptotic structure of methane-air flames Combustion and Flame 68 1987 185
22. Petzold, L., - Zu, W. (1997). Model reduction for chemical kinetics: An optimization approach. A.I.Ch.E. meeting, Los Angeles.
23. Pope S.B. An improved turbulent mixing model Combustion Science and Technology 28 1982 131
24. Pope S.B. Pdf methods for turbulent reactive flows Progress in Energy and Combustion Science 11 1985 119
25. Pope S.B. Computationally efficient implementation of combustion chemistry using in situ adaptive tabulation Combustion Theory Model 1 1997 41
26. Sirdeshpande A.R. Ierapetritou M.G. Androulakis I.P. Design of flexible reduced kinetic mechanism A.I.Ch.E. Journal 11 2001 2461
27. Tomlin, A. S., Turanyi, T., - Pilling, M. J. (1997). Mathematical methods for the construction, investigation and reduction of combustion mechanisms. In M. J. Pilling (Ed.), Low-temperature combustion and auto ignition, Chemical kinetics, Vol. 35. Amsterdam: Elsevier.
28. Vajda S. Valko P. Turanyi T. Principal component analysis of kinetic models International Journal of Chemical Kinetics 17 1985 55