- Author
-
Mitsos, A.
|
Oxberry, G. M.
|
Barton, P. I.
|
Green, W. H.
- Title
- Optimal Automatic Reaction and Species Elimination in Kinetic Mechanisms.
- Coporate
- RES Group/Numerica Technology, Cambridge, MA
Massachusetts Institute of Technology, Cambridge
- Journal
-
Combustion and Flame,
Vol. 155,
No. 1/2,
118-132,
October 2008
- Keywords
-
kinetics
|
formulation
|
equations
|
reduced mechanism
|
mass fraction
|
combustion
|
heptane
|
tolerances (mechanics)
- Identifiers
- model reduction; species elimination; adaptive chemistry; pareto optimization; reaction elimination; linear formulation for simultaneous reaction and species elimination; tradeoff between species and reaction elimination; handling third-body reactions; n-heptane mechanism; comparison of full vs reduced mechanism; CPU requirement for simulation of n-heptane case study; comparison of predictions between reduced and full models for the n-heptane combustion; tradeoff between reaction and species elimination; tradeoff of species vs reaction elimination for ignition model; effect of tolerance