Combustion Modeling - Iran First International Combustion School (ICS2019)
- Presentation of the course, learning objectives, organization
- Transport equations
- Continuity and momentum equations
- Conservation of species; diffusion fluxes (Stefan-Maxwell theory, Fick diffusion, Soret effect)
- Energy equation: enthalpy and temperature formulations
- Basics of thermodynamics, kinetics, and transport properties
- Enthalpy and specific heats, NASA polynomial formalism
- Kinetic parameters, reaction rate, reversible reactions, equilibrium constant, examples of kinetic mechanisms in CHEMKIN format, pressure-dependent reactions (third-body, fall-off reaction, Chebyshev formalism, PLOG formalism)
- Kinetic theory of gases (viscosity, mass diffusion coefficients, thermal conductivity, Lewis number)
- Introduction to the CHEMKIN formalism
- Introduction: complexity of reacting flows and combustion
- Detailed kinetics and combustion
- Non-linearity, coupling, stiffness
- The 0D reacting system model
- Governing equations
- Numerical solution of ODE systems
- The Jacobian matrix and the sparsity of kinetic mechanisms
- Ideal reacting systems in combustion
- Batch Reactor
- Shock Tube Reactor
- Perfectly Stirred Reactor
- Plug Flow Reactor
- Introduction: Combustion and transport phenomena & laminar flames
- Numerical solution of 1D flames
- Premixed laminar flames
- Burner stabilized unstretched (or flat) flame
- Governing equations and modeling aspects
- Numerical solution
- Freely-propagating unstretched (or flat) flame
- Governing equations and modeling aspects
- Burner stabilized unstretched (or flat) flame
- Counterflow diffusion flames
- Governing equations and modeling aspects
- Premixed laminar flames
- Multidimensional flames
- Introduction and examples
- Governing equations
- Numerical algorithms for multidimensional flames
- The operator-splitting method
- Acceleration of simulations by reduction of specie
- Skeletal reduction
- Quasi Steady-State Approximation (QSSA)
- Dynamic Stiffness Removal (DSR)
- Dynamic Adaptive Chemistry (DAC)
- Acceleration of simulation by reduction of reacting environments
- Reaction Network Analysis (RNA) and Kinetic Post-Processor (KPP)
- Dynamic Adaptive Clustering
- ISAT (In Situ Adaptive Tabulation)
- Species bundling for diffusion coefficient reduction
- Computation Cost Minimization
- Numerical tools for analysis of kinetic mechanisms
- Sensitivity Analysis
- Rate of Production and Reaction Path Analyses
- Introduction to turbulent flows
- Statistical description of turbulent flows
- Reynolds and Favre average
- 2-point correlations
- Turbulent eddies and energy cascade
- Kolmogorov’s Theory
- Kolmogorov’s similarity hypotheses
- Kolmogorov’s scales
- Energy spectrum
- Transport equations for mean variables
- Need of mean/filtered equations
- Averaged transport equations for continuity and momentum
- Closure models for turbulent flows: 𝜅−𝜀 model
- Favre’s averaged transport equations for passive scalars and species
- Introduction to turbulent combustion modeling
- Fluid dynamic and chemical time scales
- Effects of turbulent fluctuations on chemical reactions
- Need of turbulent combustion models
- Non-premixed combustion
- Eddy Dissipation models: ED, ED-FR, EDC
- Steady Laminar Flamelet model
- Mixture fraction
- Flamelet equations
- Presumed PDF approach
- Premixed combustion
- Eddy Break-Up (EBU) model
- Bray-Libby-Moss (BLM) model
- G-Equation