New modular solver framework for single- and multi-region simulations

in which different solver modules can be selected in each region to for complex
conjugate heat-transfer and other combined physics problems such as FSI
(fluid-structure interaction).

For single-region simulations the solver module is selected, instantiated and
executed in the PIMPLE loop in the new foamRun application.

For multi-region simulations the set of solver modules, one for each region, are
selected, instantiated and executed in the multi-region PIMPLE loop of new the
foamMultiRun application.

This provides a very general, flexible and extensible framework for complex
coupled problems by creating more solver modules, either by converting existing
solver applications or creating new ones.

The current set of solver modules provided are:

isothermalFluid
    Solver module for steady or transient turbulent flow of compressible
    isothermal fluids with optional mesh motion and mesh topology changes.

    Created from the rhoSimpleFoam, rhoPimpleFoam and buoyantFoam solvers but
    without the energy equation, hence isothermal.  The buoyant pressure
    formulation corresponding to the buoyantFoam solver is selected
    automatically by the presence of the p_rgh pressure field in the start-time
    directory.

fluid
    Solver module for steady or transient turbulent flow of compressible fluids
    with heat-transfer for HVAC and similar applications, with optional
    mesh motion and mesh topology changes.

    Derived from the isothermalFluid solver module with the addition of the
    energy equation from the rhoSimpleFoam, rhoPimpleFoam and buoyantFoam
    solvers, thus providing the equivalent functionality of these three solvers.

multicomponentFluid
    Solver module for steady or transient turbulent flow of compressible
    reacting fluids with optional mesh motion and mesh topology changes.

    Derived from the isothermalFluid solver module with the addition of
    multicomponent thermophysical properties energy and specie mass-fraction
    equations from the reactingFoam solver, thus providing the equivalent
    functionality in reactingFoam and buoyantReactingFoam.  Chemical reactions
    and/or combustion modelling may be optionally selected to simulate reacting
    systems including fires, explosions etc.

solid
    Solver module for turbulent flow of compressible fluids for conjugate heat
    transfer, HVAC and similar applications, with optional mesh motion and mesh
    topology changes.

    The solid solver module may be selected in solid regions of a CHT case, with
    either the fluid or multicomponentFluid solver module in the fluid regions
    and executed with foamMultiRun to provide functionality equivalent
    chtMultiRegionFoam but in a flexible and extensible framework for future
    extension to more complex coupled problems.

All the usual fvModels, fvConstraints, functionObjects etc. are available with
these solver modules to support simulations including body-forces, local sources,
Lagrangian clouds, liquid films etc. etc.

Converting compressibleInterFoam and multiphaseEulerFoam into solver modules
would provide a significant enhancement to the CHT capability and incompressible
solvers like pimpleFoam run in conjunction with solidDisplacementFoam in
foamMultiRun would be useful for a range of FSI problems.  Many other
combinations of existing solvers converted into solver modules could prove
useful for a very wide range of complex combined physics simulations.

All tutorials from the rhoSimpleFoam, rhoPimpleFoam, buoyantFoam, reactingFoam,
buoyantReactingFoam and chtMultiRegionFoam solver applications replaced by
solver modules have been updated and moved into the tutorials/modules directory:

modules
├── CHT
│   ├── coolingCylinder2D
│   ├── coolingSphere
│   ├── heatedDuct
│   ├── heatExchanger
│   ├── reverseBurner
│   └── shellAndTubeHeatExchanger
├── fluid
│   ├── aerofoilNACA0012
│   ├── aerofoilNACA0012Steady
│   ├── angledDuct
│   ├── angledDuctExplicitFixedCoeff
│   ├── angledDuctLTS
│   ├── annularThermalMixer
│   ├── BernardCells
│   ├── blockedChannel
│   ├── buoyantCavity
│   ├── cavity
│   ├── circuitBoardCooling
│   ├── decompressionTank
│   ├── externalCoupledCavity
│   ├── forwardStep
│   ├── helmholtzResonance
│   ├── hotRadiationRoom
│   ├── hotRadiationRoomFvDOM
│   ├── hotRoom
│   ├── hotRoomBoussinesq
│   ├── hotRoomBoussinesqSteady
│   ├── hotRoomComfort
│   ├── iglooWithFridges
│   ├── mixerVessel2DMRF
│   ├── nacaAirfoil
│   ├── pitzDaily
│   ├── prism
│   ├── shockTube
│   ├── squareBend
│   ├── squareBendLiq
│   └── squareBendLiqSteady
└── multicomponentFluid
    ├── aachenBomb
    ├── counterFlowFlame2D
    ├── counterFlowFlame2D_GRI
    ├── counterFlowFlame2D_GRI_TDAC
    ├── counterFlowFlame2DLTS
    ├── counterFlowFlame2DLTS_GRI_TDAC
    ├── cylinder
    ├── DLR_A_LTS
    ├── filter
    ├── hotBoxes
    ├── membrane
    ├── parcelInBox
    ├── rivuletPanel
    ├── SandiaD_LTS
    ├── simplifiedSiwek
    ├── smallPoolFire2D
    ├── smallPoolFire3D
    ├── splashPanel
    ├── verticalChannel
    ├── verticalChannelLTS
    └── verticalChannelSteady

Also redirection scripts are provided for the replaced solvers which call
foamRun -solver <solver module name> or foamMultiRun in the case of
chtMultiRegionFoam for backward-compatibility.

Documentation for foamRun and foamMultiRun:

Application
    foamRun

Description
    Loads and executes an OpenFOAM solver module either specified by the
    optional \c solver entry in the \c controlDict or as a command-line
    argument.

    Uses the flexible PIMPLE (PISO-SIMPLE) solution for time-resolved and
    pseudo-transient and steady simulations.

Usage
    \b foamRun [OPTION]

      - \par -solver <name>
        Solver name

      - \par -libs '(\"lib1.so\" ... \"libN.so\")'
        Specify the additional libraries loaded

    Example usage:
      - To run a \c rhoPimpleFoam case by specifying the solver on the
        command line:
        \verbatim
            foamRun -solver fluid
        \endverbatim

      - To update and run a \c rhoPimpleFoam case add the following entries to
        the controlDict:
        \verbatim
            application     foamRun;

            solver          fluid;
        \endverbatim
        then execute \c foamRun

Application
    foamMultiRun

Description
    Loads and executes an OpenFOAM solver modules for each region of a
    multiregion simulation e.g. for conjugate heat transfer.

    The region solvers are specified in the \c regionSolvers dictionary entry in
    \c controlDict, containing a list of pairs of region and solver names,
    e.g. for a two region case with one fluid region named
    liquid and one solid region named tubeWall:
    \verbatim
        regionSolvers
        {
            liquid          fluid;
            tubeWall        solid;
        }
    \endverbatim

    The \c regionSolvers entry is a dictionary to support name substitutions to
    simplify the specification of a single solver type for a set of
    regions, e.g.
    \verbatim
        fluidSolver     fluid;
        solidSolver     solid;

        regionSolvers
        {
            tube1             $fluidSolver;
            tubeWall1         solid;
            tube2             $fluidSolver;
            tubeWall2         solid;
            tube3             $fluidSolver;
            tubeWall3         solid;
        }
    \endverbatim

    Uses the flexible PIMPLE (PISO-SIMPLE) solution for time-resolved and
    pseudo-transient and steady simulations.

Usage
    \b foamMultiRun [OPTION]

      - \par -libs '(\"lib1.so\" ... \"libN.so\")'
        Specify the additional libraries loaded

    Example usage:
      - To update and run a \c chtMultiRegion case add the following entries to
        the controlDict:
        \verbatim
            application     foamMultiRun;

            regionSolvers
            {
                fluid           fluid;
                solid           solid;
            }
        \endverbatim
        then execute \c foamMultiRun
This commit is contained in:
Henry Weller
2022-08-04 21:11:35 +01:00
parent 7e2dd6dda2
commit 968e60148a
1540 changed files with 5034 additions and 5070 deletions

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CH4;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0.245642;
}
inletair
{
type fixedValue;
value uniform 0;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,41 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object G;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 0 -3 0 0 0 0];
internalField uniform 0;
boundaryField
{
".*"
{
type MarshakRadiation;
T T;
emissivityMode lookup;
emissivity uniform 1.0;
value uniform 0;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0.046496;
}
inletair
{
type fixedValue;
value uniform 0;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.005008;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0;
}
inletair
{
type fixedValue;
value uniform 0.005008;
}
outlet
{
type inletOutlet;
inletValue uniform 0.005008;
value uniform 0.005008;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object N2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.763149;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0.707861;
}
inletair
{
type fixedValue;
value uniform 0.763149;
}
outlet
{
type inletOutlet;
inletValue uniform 0.763149;
value uniform 0.763149;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object O2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.231843;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0;
}
inletair
{
type fixedValue;
value uniform 0.231843;
}
outlet
{
type inletOutlet;
inletValue uniform 0.231843;
value uniform 0.231843;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object T;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 1 0 0 0];
internalField uniform 292;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 292;
}
inletair
{
type fixedValue;
value uniform 292;
}
outlet
{
type inletOutlet;
inletValue uniform 292;
value uniform 292;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volVectorField;
location "0";
object U;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 1 -1 0 0 0 0];
internalField uniform (0 0 0.3);
boundaryField
{
inletfuel
{
type fixedValue;
value uniform (0 0 42.2);
}
inletair
{
type fixedValue;
value uniform (0 0 0.3);
}
outlet
{
type pressureInletOutletVelocity;
value uniform (0 0 0.3);
}
axis
{
type empty;
}
leftside
{
type fixedValue;
value uniform (0 0 0.3);
}
burnerwall
{
type fixedValue;
value uniform (0 0 0);
}
burnertip
{
type fixedValue;
value uniform (0 0 0);
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object Ydefault;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletfuel
{
type fixedValue;
value uniform 0;
}
inletair
{
type fixedValue;
value uniform 0;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,71 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object alphat;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletfuel
{
type calculated;
value uniform 0;
}
inletair
{
type calculated;
value uniform 0;
}
outlet
{
type calculated;
value uniform 0;
}
axis
{
type empty;
}
leftside
{
type compressible::alphatWallFunction;
Prt 0.85;
value uniform 0;
}
burnerwall
{
type compressible::alphatWallFunction;
Prt 0.85;
value uniform 0;
}
burnertip
{
type compressible::alphatWallFunction;
Prt 0.85;
value uniform 0;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,84 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object epsilon;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -3 0 0 0 0];
internalField uniform 200;
boundaryField
{
inletfuel
{
type turbulentMixingLengthDissipationRateInlet;
mixingLength 0.005;
phi phi;
k k;
value uniform 200;
}
inletair
{
type turbulentMixingLengthDissipationRateInlet;
mixingLength 0.005;
phi phi;
k k;
value uniform 200;
}
outlet
{
type inletOutlet;
inletValue uniform 200;
value uniform 200;
}
axis
{
type empty;
}
leftside
{
type epsilonWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 200;
}
burnerwall
{
type epsilonWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 200;
}
burnertip
{
type epsilonWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 200;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,71 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object k;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -2 0 0 0 0];
internalField uniform 1;
boundaryField
{
inletfuel
{
type turbulentIntensityKineticEnergyInlet;
intensity 0.08;
value uniform 1;
}
inletair
{
type turbulentIntensityKineticEnergyInlet;
intensity 0.02;
value uniform 1;
}
outlet
{
type inletOutlet;
inletValue uniform 1;
value uniform 1;
}
axis
{
type empty;
}
leftside
{
type kqRWallFunction;
value uniform 1;
}
burnerwall
{
type kqRWallFunction;
value uniform 1;
}
burnertip
{
type kqRWallFunction;
value uniform 1;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,77 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object mut;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletfuel
{
type calculated;
value uniform 0;
}
inletair
{
type calculated;
value uniform 0;
}
outlet
{
type calculated;
value uniform 0;
}
axis
{
type empty;
}
leftside
{
type nutkWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 0;
}
burnerwall
{
type nutkWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 0;
}
burnertip
{
type nutkWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 0;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,63 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object p;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -2 0 0 0 0];
internalField uniform 101325;
boundaryField
{
inletfuel
{
type zeroGradient;
}
inletair
{
type zeroGradient;
}
outlet
{
type totalPressure;
p0 $internalField;
}
axis
{
type empty;
}
leftside
{
type zeroGradient;
}
burnerwall
{
type zeroGradient;
}
burnertip
{
type zeroGradient;
}
front
{
type wedge;
}
back
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,20 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/RunFunctions
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/grimech30.dat chemkin/thermo30.dat chemkin/transportProperties \
constant/reactionsGRI constant/thermo.compressibleGasGRI
runApplication blockMesh
runApplication setFields
runApplication decomposePar -force
runParallel $application
runApplication reconstructPar
#------------------------------------------------------------------------------

View File

@ -0,0 +1,328 @@
! GRI-Mech Version 3.0 7/30/99 CHEMKIN-II format
! See README30 file at anonymous FTP site unix.sri.com, directory gri;
! WorldWideWeb home page http://www.me.berkeley.edu/gri_mech/ or
! through http://www.gri.org , under 'Basic Research',
! for additional information, contacts, and disclaimer
ELEMENTS
O H C N AR
END
SPECIES
H2 H O O2 OH H2O HO2 H2O2
C CH CH2 CH2(S) CH3 CH4 CO CO2
HCO CH2O CH2OH CH3O CH3OH C2H C2H2 C2H3
C2H4 C2H5 C2H6 HCCO CH2CO HCCOH N2 AR
C3H7 C3H8 CH2CHO CH3CHO
END
!THERMO
! Insert GRI-Mech thermodynamics here or use in default file
!END
REACTIONS
2O+M<=>O2+M 1.200E+17 -1.000 .00
H2/ 2.40/ H2O/15.40/ CH4/ 2.00/ CO/ 1.75/ CO2/ 3.60/ C2H6/ 3.00/ AR/ .83/
O+H+M<=>OH+M 5.000E+17 -1.000 .00
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+H2<=>H+OH 3.870E+04 2.700 6260.00
O+HO2<=>OH+O2 2.000E+13 .000 .00
O+H2O2<=>OH+HO2 9.630E+06 2.000 4000.00
O+CH<=>H+CO 5.700E+13 .000 .00
O+CH2<=>H+HCO 8.000E+13 .000 .00
O+CH2(S)<=>H2+CO 1.500E+13 .000 .00
O+CH2(S)<=>H+HCO 1.500E+13 .000 .00
O+CH3<=>H+CH2O 5.060E+13 .000 .00
O+CH4<=>OH+CH3 1.020E+09 1.500 8600.00
O+CO(+M)<=>CO2(+M) 1.800E+10 .000 2385.00
LOW/ 6.020E+14 .000 3000.00/
H2/2.00/ O2/6.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/3.50/ C2H6/3.00/ AR/ .50/
O+HCO<=>OH+CO 3.000E+13 .000 .00
O+HCO<=>H+CO2 3.000E+13 .000 .00
O+CH2O<=>OH+HCO 3.900E+13 .000 3540.00
O+CH2OH<=>OH+CH2O 1.000E+13 .000 .00
O+CH3O<=>OH+CH2O 1.000E+13 .000 .00
O+CH3OH<=>OH+CH2OH 3.880E+05 2.500 3100.00
O+CH3OH<=>OH+CH3O 1.300E+05 2.500 5000.00
O+C2H<=>CH+CO 5.000E+13 .000 .00
O+C2H2<=>H+HCCO 1.350E+07 2.000 1900.00
O+C2H2<=>OH+C2H 4.600E+19 -1.410 28950.00
O+C2H2<=>CO+CH2 6.940E+06 2.000 1900.00
O+C2H3<=>H+CH2CO 3.000E+13 .000 .00
O+C2H4<=>CH3+HCO 1.250E+07 1.830 220.00
O+C2H5<=>CH3+CH2O 2.240E+13 .000 .00
O+C2H6<=>OH+C2H5 8.980E+07 1.920 5690.00
O+HCCO<=>H+2CO 1.000E+14 .000 .00
O+CH2CO<=>OH+HCCO 1.000E+13 .000 8000.00
O+CH2CO<=>CH2+CO2 1.750E+12 .000 1350.00
O2+CO<=>O+CO2 2.500E+12 .000 47800.00
O2+CH2O<=>HO2+HCO 1.000E+14 .000 40000.00
H+O2+M<=>HO2+M 2.800E+18 -.860 .00
O2/ .00/ H2O/ .00/ CO/ .75/ CO2/1.50/ C2H6/1.50/ N2/ .00/ AR/ .00/
H+2O2<=>HO2+O2 2.080E+19 -1.240 .00
H+O2+H2O<=>HO2+H2O 11.26E+18 -.760 .00
H+O2+N2<=>HO2+N2 2.600E+19 -1.240 .00
H+O2+AR<=>HO2+AR 7.000E+17 -.800 .00
H+O2<=>O+OH 2.650E+16 -.6707 17041.00
2H+M<=>H2+M 1.000E+18 -1.000 .00
H2/ .00/ H2O/ .00/ CH4/2.00/ CO2/ .00/ C2H6/3.00/ AR/ .63/
2H+H2<=>2H2 9.000E+16 -.600 .00
2H+H2O<=>H2+H2O 6.000E+19 -1.250 .00
2H+CO2<=>H2+CO2 5.500E+20 -2.000 .00
H+OH+M<=>H2O+M 2.200E+22 -2.000 .00
H2/ .73/ H2O/3.65/ CH4/2.00/ C2H6/3.00/ AR/ .38/
H+HO2<=>O+H2O 3.970E+12 .000 671.00
H+HO2<=>O2+H2 4.480E+13 .000 1068.00
H+HO2<=>2OH 0.840E+14 .000 635.00
H+H2O2<=>HO2+H2 1.210E+07 2.000 5200.00
H+H2O2<=>OH+H2O 1.000E+13 .000 3600.00
H+CH<=>C+H2 1.650E+14 .000 .00
H+CH2(+M)<=>CH3(+M) 6.000E+14 .000 .00
LOW / 1.040E+26 -2.760 1600.00/
TROE/ .5620 91.00 5836.00 8552.00/
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+CH2(S)<=>CH+H2 3.000E+13 .000 .00
H+CH3(+M)<=>CH4(+M) 13.90E+15 -.534 536.00
LOW / 2.620E+33 -4.760 2440.00/
TROE/ .7830 74.00 2941.00 6964.00 /
H2/2.00/ H2O/6.00/ CH4/3.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+CH4<=>CH3+H2 6.600E+08 1.620 10840.00
H+HCO(+M)<=>CH2O(+M) 1.090E+12 .480 -260.00
LOW / 2.470E+24 -2.570 425.00/
TROE/ .7824 271.00 2755.00 6570.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+HCO<=>H2+CO 7.340E+13 .000 .00
H+CH2O(+M)<=>CH2OH(+M) 5.400E+11 .454 3600.00
LOW / 1.270E+32 -4.820 6530.00/
TROE/ .7187 103.00 1291.00 4160.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2O(+M)<=>CH3O(+M) 5.400E+11 .454 2600.00
LOW / 2.200E+30 -4.800 5560.00/
TROE/ .7580 94.00 1555.00 4200.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2O<=>HCO+H2 5.740E+07 1.900 2742.00
H+CH2OH(+M)<=>CH3OH(+M) 1.055E+12 .500 86.00
LOW / 4.360E+31 -4.650 5080.00/
TROE/ .600 100.00 90000.0 10000.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2OH<=>H2+CH2O 2.000E+13 .000 .00
H+CH2OH<=>OH+CH3 1.650E+11 .650 -284.00
H+CH2OH<=>CH2(S)+H2O 3.280E+13 -.090 610.00
H+CH3O(+M)<=>CH3OH(+M) 2.430E+12 .515 50.00
LOW / 4.660E+41 -7.440 14080.0/
TROE/ .700 100.00 90000.0 10000.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH3O<=>H+CH2OH 4.150E+07 1.630 1924.00
H+CH3O<=>H2+CH2O 2.000E+13 .000 .00
H+CH3O<=>OH+CH3 1.500E+12 .500 -110.00
H+CH3O<=>CH2(S)+H2O 2.620E+14 -.230 1070.00
H+CH3OH<=>CH2OH+H2 1.700E+07 2.100 4870.00
H+CH3OH<=>CH3O+H2 4.200E+06 2.100 4870.00
H+C2H(+M)<=>C2H2(+M) 1.000E+17 -1.000 .00
LOW / 3.750E+33 -4.800 1900.00/
TROE/ .6464 132.00 1315.00 5566.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H2(+M)<=>C2H3(+M) 5.600E+12 .000 2400.00
LOW / 3.800E+40 -7.270 7220.00/
TROE/ .7507 98.50 1302.00 4167.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H3(+M)<=>C2H4(+M) 6.080E+12 .270 280.00
LOW / 1.400E+30 -3.860 3320.00/
TROE/ .7820 207.50 2663.00 6095.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H3<=>H2+C2H2 3.000E+13 .000 .00
H+C2H4(+M)<=>C2H5(+M) 0.540E+12 .454 1820.00
LOW / 0.600E+42 -7.620 6970.00/
TROE/ .9753 210.00 984.00 4374.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H4<=>C2H3+H2 1.325E+06 2.530 12240.00
H+C2H5(+M)<=>C2H6(+M) 5.210E+17 -.990 1580.00
LOW / 1.990E+41 -7.080 6685.00/
TROE/ .8422 125.00 2219.00 6882.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H5<=>H2+C2H4 2.000E+12 .000 .00
H+C2H6<=>C2H5+H2 1.150E+08 1.900 7530.00
H+HCCO<=>CH2(S)+CO 1.000E+14 .000 .00
H+CH2CO<=>HCCO+H2 5.000E+13 .000 8000.00
H+CH2CO<=>CH3+CO 1.130E+13 .000 3428.00
H+HCCOH<=>H+CH2CO 1.000E+13 .000 .00
H2+CO(+M)<=>CH2O(+M) 4.300E+07 1.500 79600.00
LOW / 5.070E+27 -3.420 84350.00/
TROE/ .9320 197.00 1540.00 10300.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
OH+H2<=>H+H2O 2.160E+08 1.510 3430.00
2OH(+M)<=>H2O2(+M) 7.400E+13 -.370 .00
LOW / 2.300E+18 -.900 -1700.00/
TROE/ .7346 94.00 1756.00 5182.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
2OH<=>O+H2O 3.570E+04 2.400 -2110.00
OH+HO2<=>O2+H2O 1.450E+13 .000 -500.00
DUPLICATE
OH+H2O2<=>HO2+H2O 2.000E+12 .000 427.00
DUPLICATE
OH+H2O2<=>HO2+H2O 1.700E+18 .000 29410.00
DUPLICATE
OH+C<=>H+CO 5.000E+13 .000 .00
OH+CH<=>H+HCO 3.000E+13 .000 .00
OH+CH2<=>H+CH2O 2.000E+13 .000 .00
OH+CH2<=>CH+H2O 1.130E+07 2.000 3000.00
OH+CH2(S)<=>H+CH2O 3.000E+13 .000 .00
OH+CH3(+M)<=>CH3OH(+M) 2.790E+18 -1.430 1330.00
LOW / 4.000E+36 -5.920 3140.00/
TROE/ .4120 195.0 5900.00 6394.00/
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
OH+CH3<=>CH2+H2O 5.600E+07 1.600 5420.00
OH+CH3<=>CH2(S)+H2O 6.440E+17 -1.340 1417.00
OH+CH4<=>CH3+H2O 1.000E+08 1.600 3120.00
OH+CO<=>H+CO2 4.760E+07 1.228 70.00
OH+HCO<=>H2O+CO 5.000E+13 .000 .00
OH+CH2O<=>HCO+H2O 3.430E+09 1.180 -447.00
OH+CH2OH<=>H2O+CH2O 5.000E+12 .000 .00
OH+CH3O<=>H2O+CH2O 5.000E+12 .000 .00
OH+CH3OH<=>CH2OH+H2O 1.440E+06 2.000 -840.00
OH+CH3OH<=>CH3O+H2O 6.300E+06 2.000 1500.00
OH+C2H<=>H+HCCO 2.000E+13 .000 .00
OH+C2H2<=>H+CH2CO 2.180E-04 4.500 -1000.00
OH+C2H2<=>H+HCCOH 5.040E+05 2.300 13500.00
OH+C2H2<=>C2H+H2O 3.370E+07 2.000 14000.00
OH+C2H2<=>CH3+CO 4.830E-04 4.000 -2000.00
OH+C2H3<=>H2O+C2H2 5.000E+12 .000 .00
OH+C2H4<=>C2H3+H2O 3.600E+06 2.000 2500.00
OH+C2H6<=>C2H5+H2O 3.540E+06 2.120 870.00
OH+CH2CO<=>HCCO+H2O 7.500E+12 .000 2000.00
2HO2<=>O2+H2O2 1.300E+11 .000 -1630.00
DUPLICATE
2HO2<=>O2+H2O2 4.200E+14 .000 12000.00
DUPLICATE
HO2+CH2<=>OH+CH2O 2.000E+13 .000 .00
HO2+CH3<=>O2+CH4 1.000E+12 .000 .00
HO2+CH3<=>OH+CH3O 3.780E+13 .000 .00
HO2+CO<=>OH+CO2 1.500E+14 .000 23600.00
HO2+CH2O<=>HCO+H2O2 5.600E+06 2.000 12000.00
C+O2<=>O+CO 5.800E+13 .000 576.00
C+CH2<=>H+C2H 5.000E+13 .000 .00
C+CH3<=>H+C2H2 5.000E+13 .000 .00
CH+O2<=>O+HCO 6.710E+13 .000 .00
CH+H2<=>H+CH2 1.080E+14 .000 3110.00
CH+H2O<=>H+CH2O 5.710E+12 .000 -755.00
CH+CH2<=>H+C2H2 4.000E+13 .000 .00
CH+CH3<=>H+C2H3 3.000E+13 .000 .00
CH+CH4<=>H+C2H4 6.000E+13 .000 .00
CH+CO(+M)<=>HCCO(+M) 5.000E+13 .000 .00
LOW / 2.690E+28 -3.740 1936.00/
TROE/ .5757 237.00 1652.00 5069.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH+CO2<=>HCO+CO 1.900E+14 .000 15792.00
CH+CH2O<=>H+CH2CO 9.460E+13 .000 -515.00
CH+HCCO<=>CO+C2H2 5.000E+13 .000 .00
CH2+O2=>OH+H+CO 5.000E+12 .000 1500.00
CH2+H2<=>H+CH3 5.000E+05 2.000 7230.00
2CH2<=>H2+C2H2 1.600E+15 .000 11944.00
CH2+CH3<=>H+C2H4 4.000E+13 .000 .00
CH2+CH4<=>2CH3 2.460E+06 2.000 8270.00
CH2+CO(+M)<=>CH2CO(+M) 8.100E+11 .500 4510.00
LOW / 2.690E+33 -5.110 7095.00/
TROE/ .5907 275.00 1226.00 5185.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH2+HCCO<=>C2H3+CO 3.000E+13 .000 .00
CH2(S)+N2<=>CH2+N2 1.500E+13 .000 600.00
CH2(S)+AR<=>CH2+AR 9.000E+12 .000 600.00
CH2(S)+O2<=>H+OH+CO 2.800E+13 .000 .00
CH2(S)+O2<=>CO+H2O 1.200E+13 .000 .00
CH2(S)+H2<=>CH3+H 7.000E+13 .000 .00
CH2(S)+H2O(+M)<=>CH3OH(+M) 4.820E+17 -1.160 1145.00
LOW / 1.880E+38 -6.360 5040.00/
TROE/ .6027 208.00 3922.00 10180.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
CH2(S)+H2O<=>CH2+H2O 3.000E+13 .000 .00
CH2(S)+CH3<=>H+C2H4 1.200E+13 .000 -570.00
CH2(S)+CH4<=>2CH3 1.600E+13 .000 -570.00
CH2(S)+CO<=>CH2+CO 9.000E+12 .000 .00
CH2(S)+CO2<=>CH2+CO2 7.000E+12 .000 .00
CH2(S)+CO2<=>CO+CH2O 1.400E+13 .000 .00
CH2(S)+C2H6<=>CH3+C2H5 4.000E+13 .000 -550.00
CH3+O2<=>O+CH3O 3.560E+13 .000 30480.00
CH3+O2<=>OH+CH2O 2.310E+12 .000 20315.00
CH3+H2O2<=>HO2+CH4 2.450E+04 2.470 5180.00
2CH3(+M)<=>C2H6(+M) 6.770E+16 -1.180 654.00
LOW / 3.400E+41 -7.030 2762.00/
TROE/ .6190 73.20 1180.00 9999.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
2CH3<=>H+C2H5 6.840E+12 .100 10600.00
CH3+HCO<=>CH4+CO 2.648E+13 .000 .00
CH3+CH2O<=>HCO+CH4 3.320E+03 2.810 5860.00
CH3+CH3OH<=>CH2OH+CH4 3.000E+07 1.500 9940.00
CH3+CH3OH<=>CH3O+CH4 1.000E+07 1.500 9940.00
CH3+C2H4<=>C2H3+CH4 2.270E+05 2.000 9200.00
CH3+C2H6<=>C2H5+CH4 6.140E+06 1.740 10450.00
HCO+H2O<=>H+CO+H2O 1.500E+18 -1.000 17000.00
HCO+M<=>H+CO+M 1.870E+17 -1.000 17000.00
H2/2.00/ H2O/ .00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
HCO+O2<=>HO2+CO 13.45E+12 .000 400.00
CH2OH+O2<=>HO2+CH2O 1.800E+13 .000 900.00
CH3O+O2<=>HO2+CH2O 4.280E-13 7.600 -3530.00
C2H+O2<=>HCO+CO 1.000E+13 .000 -755.00
C2H+H2<=>H+C2H2 5.680E+10 0.900 1993.00
C2H3+O2<=>HCO+CH2O 4.580E+16 -1.390 1015.00
C2H4(+M)<=>H2+C2H2(+M) 8.000E+12 .440 86770.00
LOW / 1.580E+51 -9.300 97800.00/
TROE/ .7345 180.00 1035.00 5417.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
C2H5+O2<=>HO2+C2H4 8.400E+11 .000 3875.00
HCCO+O2<=>OH+2CO 3.200E+12 .000 854.00
2HCCO<=>2CO+C2H2 1.000E+13 .000 .00
O+CH3=>H+H2+CO 3.370E+13 .000 .00
O+C2H4<=>H+CH2CHO 6.700E+06 1.830 220.00
O+C2H5<=>H+CH3CHO 1.096E+14 .000 .00
OH+HO2<=>O2+H2O 0.500E+16 .000 17330.00
DUPLICATE
OH+CH3=>H2+CH2O 8.000E+09 .500 -1755.00
CH+H2(+M)<=>CH3(+M) 1.970E+12 .430 -370.00
LOW/ 4.820E+25 -2.80 590.0 /
TROE/ .578 122.0 2535.0 9365.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH2+O2=>2H+CO2 5.800E+12 .000 1500.00
CH2+O2<=>O+CH2O 2.400E+12 .000 1500.00
CH2+CH2=>2H+C2H2 2.000E+14 .000 10989.00
CH2(S)+H2O=>H2+CH2O 6.820E+10 .250 -935.00
C2H3+O2<=>O+CH2CHO 3.030E+11 .290 11.00
C2H3+O2<=>HO2+C2H2 1.337E+06 1.610 -384.00
O+CH3CHO<=>OH+CH2CHO 2.920E+12 .000 1808.00
O+CH3CHO=>OH+CH3+CO 2.920E+12 .000 1808.00
O2+CH3CHO=>HO2+CH3+CO 3.010E+13 .000 39150.00
H+CH3CHO<=>CH2CHO+H2 2.050E+09 1.160 2405.00
H+CH3CHO=>CH3+H2+CO 2.050E+09 1.160 2405.00
OH+CH3CHO=>CH3+H2O+CO 2.343E+10 0.730 -1113.00
HO2+CH3CHO=>CH3+H2O2+CO 3.010E+12 .000 11923.00
CH3+CH3CHO=>CH3+CH4+CO 2.720E+06 1.770 5920.00
H+CH2CO(+M)<=>CH2CHO(+M) 4.865E+11 0.422 -1755.00
LOW/ 1.012E+42 -7.63 3854.0/
TROE/ 0.465 201.0 1773.0 5333.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+CH2CHO=>H+CH2+CO2 1.500E+14 .000 .00
O2+CH2CHO=>OH+CO+CH2O 1.810E+10 .000 .00
O2+CH2CHO=>OH+2HCO 2.350E+10 .000 .00
H+CH2CHO<=>CH3+HCO 2.200E+13 .000 .00
H+CH2CHO<=>CH2CO+H2 1.100E+13 .000 .00
OH+CH2CHO<=>H2O+CH2CO 1.200E+13 .000 .00
OH+CH2CHO<=>HCO+CH2OH 3.010E+13 .000 .00
CH3+C2H5(+M)<=>C3H8(+M) .9430E+13 .000 .00
LOW/ 2.710E+74 -16.82 13065.0 /
TROE/ .1527 291.0 2742.0 7748.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+C3H8<=>OH+C3H7 1.930E+05 2.680 3716.00
H+C3H8<=>C3H7+H2 1.320E+06 2.540 6756.00
OH+C3H8<=>C3H7+H2O 3.160E+07 1.800 934.00
C3H7+H2O2<=>HO2+C3H8 3.780E+02 2.720 1500.00
CH3+C3H8<=>C3H7+CH4 0.903E+00 3.650 7154.00
CH3+C2H4(+M)<=>C3H7(+M) 2.550E+06 1.600 5700.00
LOW/ 3.00E+63 -14.6 18170./
TROE/ .1894 277.0 8748.0 7891.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+C3H7<=>C2H5+CH2O 9.640E+13 .000 .00
H+C3H7(+M)<=>C3H8(+M) 3.613E+13 .000 .00
LOW/ 4.420E+61 -13.545 11357.0/
TROE/ .315 369.0 3285.0 6667.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C3H7<=>CH3+C2H5 4.060E+06 2.190 890.00
OH+C3H7<=>C2H5+CH2OH 2.410E+13 .000 .00
HO2+C3H7<=>O2+C3H8 2.550E+10 0.255 -943.00
HO2+C3H7=>OH+C2H5+CH2O 2.410E+13 .000 .00
CH3+C3H7<=>2C2H5 1.927E+13 -0.320 .00
END

View File

@ -0,0 +1,218 @@
THERMO ALL
250.000 1000.000 5000.000
! GRI-Mech Version 3.0 Thermodynamics released 7/30/99
! NASA Polynomial format for CHEMKIN-II
! see README file for disclaimer
O L 1/90O 1 G 200.000 3500.000 1000.000 1
2.56942078E+00-8.59741137E-05 4.19484589E-08-1.00177799E-11 1.22833691E-15 2
2.92175791E+04 4.78433864E+00 3.16826710E+00-3.27931884E-03 6.64306396E-06 3
-6.12806624E-09 2.11265971E-12 2.91222592E+04 2.05193346E+00 4
O2 TPIS89O 2 G 200.000 3500.000 1000.000 1
3.28253784E+00 1.48308754E-03-7.57966669E-07 2.09470555E-10-2.16717794E-14 2
-1.08845772E+03 5.45323129E+00 3.78245636E+00-2.99673416E-03 9.84730201E-06 3
-9.68129509E-09 3.24372837E-12-1.06394356E+03 3.65767573E+00 4
H L 7/88H 1 G 200.000 3500.000 1000.000 1
2.50000001E+00-2.30842973E-11 1.61561948E-14-4.73515235E-18 4.98197357E-22 2
2.54736599E+04-4.46682914E-01 2.50000000E+00 7.05332819E-13-1.99591964E-15 3
2.30081632E-18-9.27732332E-22 2.54736599E+04-4.46682853E-01 4
H2 TPIS78H 2 G 200.000 3500.000 1000.000 1
3.33727920E+00-4.94024731E-05 4.99456778E-07-1.79566394E-10 2.00255376E-14 2
-9.50158922E+02-3.20502331E+00 2.34433112E+00 7.98052075E-03-1.94781510E-05 3
2.01572094E-08-7.37611761E-12-9.17935173E+02 6.83010238E-01 4
OH RUS 78O 1H 1 G 200.000 3500.000 1000.000 1
3.09288767E+00 5.48429716E-04 1.26505228E-07-8.79461556E-11 1.17412376E-14 2
3.85865700E+03 4.47669610E+00 3.99201543E+00-2.40131752E-03 4.61793841E-06 3
-3.88113333E-09 1.36411470E-12 3.61508056E+03-1.03925458E-01 4
H2O L 8/89H 2O 1 G 200.000 3500.000 1000.000 1
3.03399249E+00 2.17691804E-03-1.64072518E-07-9.70419870E-11 1.68200992E-14 2
-3.00042971E+04 4.96677010E+00 4.19864056E+00-2.03643410E-03 6.52040211E-06 3
-5.48797062E-09 1.77197817E-12-3.02937267E+04-8.49032208E-01 4
HO2 L 5/89H 1O 2 G 200.000 3500.000 1000.000 1
4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2
1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3
-2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4
H2O2 L 7/88H 2O 2 G 200.000 3500.000 1000.000 1
4.16500285E+00 4.90831694E-03-1.90139225E-06 3.71185986E-10-2.87908305E-14 2
-1.78617877E+04 2.91615662E+00 4.27611269E+00-5.42822417E-04 1.67335701E-05 3
-2.15770813E-08 8.62454363E-12-1.77025821E+04 3.43505074E+00 4
C L11/88C 1 G 200.000 3500.000 1000.000 1
2.49266888E+00 4.79889284E-05-7.24335020E-08 3.74291029E-11-4.87277893E-15 2
8.54512953E+04 4.80150373E+00 2.55423955E+00-3.21537724E-04 7.33792245E-07 3
-7.32234889E-10 2.66521446E-13 8.54438832E+04 4.53130848E+00 4
CH TPIS79C 1H 1 G 200.000 3500.000 1000.000 1
2.87846473E+00 9.70913681E-04 1.44445655E-07-1.30687849E-10 1.76079383E-14 2
7.10124364E+04 5.48497999E+00 3.48981665E+00 3.23835541E-04-1.68899065E-06 3
3.16217327E-09-1.40609067E-12 7.07972934E+04 2.08401108E+00 4
CH2 L S/93C 1H 2 G 200.000 3500.000 1000.000 1
2.87410113E+00 3.65639292E-03-1.40894597E-06 2.60179549E-10-1.87727567E-14 2
4.62636040E+04 6.17119324E+00 3.76267867E+00 9.68872143E-04 2.79489841E-06 3
-3.85091153E-09 1.68741719E-12 4.60040401E+04 1.56253185E+00 4
CH2(S) L S/93C 1H 2 G 200.000 3500.000 1000.000 1
2.29203842E+00 4.65588637E-03-2.01191947E-06 4.17906000E-10-3.39716365E-14 2
5.09259997E+04 8.62650169E+00 4.19860411E+00-2.36661419E-03 8.23296220E-06 3
-6.68815981E-09 1.94314737E-12 5.04968163E+04-7.69118967E-01 4
CH3 L11/89C 1H 3 G 200.000 3500.000 1000.000 1
2.28571772E+00 7.23990037E-03-2.98714348E-06 5.95684644E-10-4.67154394E-14 2
1.67755843E+04 8.48007179E+00 3.67359040E+00 2.01095175E-03 5.73021856E-06 3
-6.87117425E-09 2.54385734E-12 1.64449988E+04 1.60456433E+00 4
CH4 L 8/88C 1H 4 G 200.000 3500.000 1000.000 1
7.48514950E-02 1.33909467E-02-5.73285809E-06 1.22292535E-09-1.01815230E-13 2
-9.46834459E+03 1.84373180E+01 5.14987613E+00-1.36709788E-02 4.91800599E-05 3
-4.84743026E-08 1.66693956E-11-1.02466476E+04-4.64130376E+00 4
CO TPIS79C 1O 1 G 200.000 3500.000 1000.000 1
2.71518561E+00 2.06252743E-03-9.98825771E-07 2.30053008E-10-2.03647716E-14 2
-1.41518724E+04 7.81868772E+00 3.57953347E+00-6.10353680E-04 1.01681433E-06 3
9.07005884E-10-9.04424499E-13-1.43440860E+04 3.50840928E+00 4
CO2 L 7/88C 1O 2 G 200.000 3500.000 1000.000 1
3.85746029E+00 4.41437026E-03-2.21481404E-06 5.23490188E-10-4.72084164E-14 2
-4.87591660E+04 2.27163806E+00 2.35677352E+00 8.98459677E-03-7.12356269E-06 3
2.45919022E-09-1.43699548E-13-4.83719697E+04 9.90105222E+00 4
HCO L12/89H 1C 1O 1 G 200.000 3500.000 1000.000 1
2.77217438E+00 4.95695526E-03-2.48445613E-06 5.89161778E-10-5.33508711E-14 2
4.01191815E+03 9.79834492E+00 4.22118584E+00-3.24392532E-03 1.37799446E-05 3
-1.33144093E-08 4.33768865E-12 3.83956496E+03 3.39437243E+00 4
CH2O L 8/88H 2C 1O 1 G 200.000 3500.000 1000.000 1
1.76069008E+00 9.20000082E-03-4.42258813E-06 1.00641212E-09-8.83855640E-14 2
-1.39958323E+04 1.36563230E+01 4.79372315E+00-9.90833369E-03 3.73220008E-05 3
-3.79285261E-08 1.31772652E-11-1.43089567E+04 6.02812900E-01 4
CH2OH GUNL93C 1H 3O 1 G 200.000 3500.000 1000.000 1
3.69266569E+00 8.64576797E-03-3.75101120E-06 7.87234636E-10-6.48554201E-14 2
-3.24250627E+03 5.81043215E+00 3.86388918E+00 5.59672304E-03 5.93271791E-06 3
-1.04532012E-08 4.36967278E-12-3.19391367E+03 5.47302243E+00 4
CH3O 121686C 1H 3O 1 G 250.00 3000.00 1000.000 1
0.03770799E+02 0.07871497E-01-0.02656384E-04 0.03944431E-08-0.02112616E-12 2
0.12783252E+03 0.02929575E+02 0.02106204E+02 0.07216595E-01 0.05338472E-04 3
-0.07377636E-07 0.02075610E-10 0.09786011E+04 0.13152177E+02 4
CH3OH L 8/88C 1H 4O 1 G 200.000 3500.000 1000.000 1
1.78970791E+00 1.40938292E-02-6.36500835E-06 1.38171085E-09-1.17060220E-13 2
-2.53748747E+04 1.45023623E+01 5.71539582E+00-1.52309129E-02 6.52441155E-05 3
-7.10806889E-08 2.61352698E-11-2.56427656E+04-1.50409823E+00 4
C2H L 1/91C 2H 1 G 200.000 3500.000 1000.000 1
3.16780652E+00 4.75221902E-03-1.83787077E-06 3.04190252E-10-1.77232770E-14 2
6.71210650E+04 6.63589475E+00 2.88965733E+00 1.34099611E-02-2.84769501E-05 3
2.94791045E-08-1.09331511E-11 6.68393932E+04 6.22296438E+00 4
C2H2 L 1/91C 2H 2 G 200.000 3500.000 1000.000 1
4.14756964E+00 5.96166664E-03-2.37294852E-06 4.67412171E-10-3.61235213E-14 2
2.59359992E+04-1.23028121E+00 8.08681094E-01 2.33615629E-02-3.55171815E-05 3
2.80152437E-08-8.50072974E-12 2.64289807E+04 1.39397051E+01 4
C2H3 L 2/92C 2H 3 G 200.000 3500.000 1000.000 1
3.01672400E+00 1.03302292E-02-4.68082349E-06 1.01763288E-09-8.62607041E-14 2
3.46128739E+04 7.78732378E+00 3.21246645E+00 1.51479162E-03 2.59209412E-05 3
-3.57657847E-08 1.47150873E-11 3.48598468E+04 8.51054025E+00 4
C2H4 L 1/91C 2H 4 G 200.000 3500.000 1000.000 1
2.03611116E+00 1.46454151E-02-6.71077915E-06 1.47222923E-09-1.25706061E-13 2
4.93988614E+03 1.03053693E+01 3.95920148E+00-7.57052247E-03 5.70990292E-05 3
-6.91588753E-08 2.69884373E-11 5.08977593E+03 4.09733096E+00 4
C2H5 L12/92C 2H 5 G 200.000 3500.000 1000.000 1
1.95465642E+00 1.73972722E-02-7.98206668E-06 1.75217689E-09-1.49641576E-13 2
1.28575200E+04 1.34624343E+01 4.30646568E+00-4.18658892E-03 4.97142807E-05 3
-5.99126606E-08 2.30509004E-11 1.28416265E+04 4.70720924E+00 4
C2H6 L 8/88C 2H 6 G 200.000 3500.000 1000.000 1
1.07188150E+00 2.16852677E-02-1.00256067E-05 2.21412001E-09-1.90002890E-13 2
-1.14263932E+04 1.51156107E+01 4.29142492E+00-5.50154270E-03 5.99438288E-05 3
-7.08466285E-08 2.68685771E-11-1.15222055E+04 2.66682316E+00 4
CH2CO L 5/90C 2H 2O 1 G 200.000 3500.000 1000.000 1
4.51129732E+00 9.00359745E-03-4.16939635E-06 9.23345882E-10-7.94838201E-14 2
-7.55105311E+03 6.32247205E-01 2.13583630E+00 1.81188721E-02-1.73947474E-05 3
9.34397568E-09-2.01457615E-12-7.04291804E+03 1.22156480E+01 4
HCCO SRIC91H 1C 2O 1 G 250.00 4000.00 1000.000 1
0.56282058E+01 0.40853401E-02-0.15934547E-05 0.28626052E-09-0.19407832E-13 2
0.19327215E+05-0.39302595E+01 0.22517214E+01 0.17655021E-01-0.23729101E-04 3
0.17275759E-07-0.50664811E-11 0.20059449E+05 0.12490417E+02 4
HCCOH SRI91C 2O 1H 2 G 250.000 5000.000 1000.000 1
0.59238291E+01 0.67923600E-02-0.25658564E-05 0.44987841E-09-0.29940101E-13 2
0.72646260E+04-0.76017742E+01 0.12423733E+01 0.31072201E-01-0.50866864E-04 3
0.43137131E-07-0.14014594E-10 0.80316143E+04 0.13874319E+02 4
H2CN 41687H 2C 1N 1 G 250.00 4000.000 1000.000 1
0.52097030E+01 0.29692911E-02-0.28555891E-06-0.16355500E-09 0.30432589E-13 2
0.27677109E+05-0.44444780E+01 0.28516610E+01 0.56952331E-02 0.10711400E-05 3
-0.16226120E-08-0.23511081E-12 0.28637820E+05 0.89927511E+01 4
HCN GRI/98H 1C 1N 1 G 200.000 6000.000 1000.000 1
0.38022392E+01 0.31464228E-02-0.10632185E-05 0.16619757E-09-0.97997570E-14 2
0.14407292E+05 0.15754601E+01 0.22589886E+01 0.10051170E-01-0.13351763E-04 3
0.10092349E-07-0.30089028E-11 0.14712633E+05 0.89164419E+01 4
HNO And93 H 1N 1O 1 G 200.000 6000.000 1000.000 1
0.29792509E+01 0.34944059E-02-0.78549778E-06 0.57479594E-10-0.19335916E-15 2
0.11750582E+05 0.86063728E+01 0.45334916E+01-0.56696171E-02 0.18473207E-04 3
-0.17137094E-07 0.55454573E-11 0.11548297E+05 0.17498417E+01 4
N L 6/88N 1 G 200.000 6000.000 1000.000 1
0.24159429E+01 0.17489065E-03-0.11902369E-06 0.30226245E-10-0.20360982E-14 2
0.56133773E+05 0.46496096E+01 0.25000000E+01 0.00000000E+00 0.00000000E+00 3
0.00000000E+00 0.00000000E+00 0.56104637E+05 0.41939087E+01 4
NNH T07/93N 2H 1 G 200.000 6000.000 1000.000 1
0.37667544E+01 0.28915082E-02-0.10416620E-05 0.16842594E-09-0.10091896E-13 2
0.28650697E+05 0.44705067E+01 0.43446927E+01-0.48497072E-02 0.20059459E-04 3
-0.21726464E-07 0.79469539E-11 0.28791973E+05 0.29779410E+01 4
N2O L 7/88N 2O 1 G 200.000 6000.000 1000.000 1
0.48230729E+01 0.26270251E-02-0.95850874E-06 0.16000712E-09-0.97752303E-14 2
0.80734048E+04-0.22017207E+01 0.22571502E+01 0.11304728E-01-0.13671319E-04 3
0.96819806E-08-0.29307182E-11 0.87417744E+04 0.10757992E+02 4
NH And94 N 1H 1 G 200.000 6000.000 1000.000 1
0.27836928E+01 0.13298430E-02-0.42478047E-06 0.78348501E-10-0.55044470E-14 2
0.42120848E+05 0.57407799E+01 0.34929085E+01 0.31179198E-03-0.14890484E-05 3
0.24816442E-08-0.10356967E-11 0.41880629E+05 0.18483278E+01 4
NH2 And89 N 1H 2 G 200.000 6000.000 1000.000 1
0.28347421E+01 0.32073082E-02-0.93390804E-06 0.13702953E-09-0.79206144E-14 2
0.22171957E+05 0.65204163E+01 0.42040029E+01-0.21061385E-02 0.71068348E-05 3
-0.56115197E-08 0.16440717E-11 0.21885910E+05-0.14184248E+00 4
NH3 J 6/77N 1H 3 G 200.000 6000.000 1000.000 1
0.26344521E+01 0.56662560E-02-0.17278676E-05 0.23867161E-09-0.12578786E-13 2
-0.65446958E+04 0.65662928E+01 0.42860274E+01-0.46605230E-02 0.21718513E-04 3
-0.22808887E-07 0.82638046E-11-0.67417285E+04-0.62537277E+00 4
NO RUS 78N 1O 1 G 200.000 6000.000 1000.000 1
0.32606056E+01 0.11911043E-02-0.42917048E-06 0.69457669E-10-0.40336099E-14 2
0.99209746E+04 0.63693027E+01 0.42184763E+01-0.46389760E-02 0.11041022E-04 3
-0.93361354E-08 0.28035770E-11 0.98446230E+04 0.22808464E+01 4
NO2 L 7/88N 1O 2 G 200.000 6000.000 1000.000 1
0.48847542E+01 0.21723956E-02-0.82806906E-06 0.15747510E-09-0.10510895E-13 2
0.23164983E+04-0.11741695E+00 0.39440312E+01-0.15854290E-02 0.16657812E-04 3
-0.20475426E-07 0.78350564E-11 0.28966179E+04 0.63119917E+01 4
HCNO BDEA94H 1N 1C 1O 1G 250.000 5000.000 1382.000 1
6.59860456E+00 3.02778626E-03-1.07704346E-06 1.71666528E-10-1.01439391E-14 2
1.79661339E+04-1.03306599E+01 2.64727989E+00 1.27505342E-02-1.04794236E-05 3
4.41432836E-09-7.57521466E-13 1.92990252E+04 1.07332972E+01 4
HOCN BDEA94H 1N 1C 1O 1G 250.000 5000.000 1368.000 1
5.89784885E+00 3.16789393E-03-1.11801064E-06 1.77243144E-10-1.04339177E-14 2
-3.70653331E+03-6.18167825E+00 3.78604952E+00 6.88667922E-03-3.21487864E-06 3
5.17195767E-10 1.19360788E-14-2.82698400E+03 5.63292162E+00 4
HNCO BDEA94H 1N 1C 1O 1G 250.000 5000.000 1478.000 1
6.22395134E+00 3.17864004E-03-1.09378755E-06 1.70735163E-10-9.95021955E-15 2
-1.66599344E+04-8.38224741E+00 3.63096317E+00 7.30282357E-03-2.28050003E-06 3
-6.61271298E-10 3.62235752E-13-1.55873636E+04 6.19457727E+00 4
NCO EA 93 N 1C 1O 1 G 200.000 6000.000 1000.000 1
0.51521845E+01 0.23051761E-02-0.88033153E-06 0.14789098E-09-0.90977996E-14 2
0.14004123E+05-0.25442660E+01 0.28269308E+01 0.88051688E-02-0.83866134E-05 3
0.48016964E-08-0.13313595E-11 0.14682477E+05 0.95504646E+01 4
CN HBH92 C 1N 1 G 200.000 6000.000 1000.000 1
0.37459805E+01 0.43450775E-04 0.29705984E-06-0.68651806E-10 0.44134173E-14 2
0.51536188E+05 0.27867601E+01 0.36129351E+01-0.95551327E-03 0.21442977E-05 3
-0.31516323E-09-0.46430356E-12 0.51708340E+05 0.39804995E+01 4
HCNN SRI/94C 1N 2H 1 G 250.000 5000.000 1000.000 1
0.58946362E+01 0.39895959E-02-0.15982380E-05 0.29249395E-09-0.20094686E-13 2
0.53452941E+05-0.51030502E+01 0.25243194E+01 0.15960619E-01-0.18816354E-04 3
0.12125540E-07-0.32357378E-11 0.54261984E+05 0.11675870E+02 4
N2 121286N 2 G 250.000 5000.000 1000.000 1
0.02926640E+02 0.14879768E-02-0.05684760E-05 0.10097038E-09-0.06753351E-13 2
-0.09227977E+04 0.05980528E+02 0.03298677E+02 0.14082404E-02-0.03963222E-04 3
0.05641515E-07-0.02444854E-10-0.10208999E+04 0.03950372E+02 4
AR 120186AR 1 G 250.000 5000.000 1000.000 1
0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2
-0.07453750E+04 0.04366000E+02 0.02500000E+02 0.00000000E+00 0.00000000E+00 3
0.00000000E+00 0.00000000E+00-0.07453750E+04 0.04366000E+02 4
C3H8 L 4/85C 3H 8 G 250.000 5000.000 1000.000 1
0.75341368E+01 0.18872239E-01-0.62718491E-05 0.91475649E-09-0.47838069E-13 2
-0.16467516E+05-0.17892349E+02 0.93355381E+00 0.26424579E-01 0.61059727E-05 3
-0.21977499E-07 0.95149253E-11-0.13958520E+05 0.19201691E+02 4
C3H7 L 9/84C 3H 7 G 250.000 5000.000 1000.000 1
0.77026987E+01 0.16044203E-01-0.52833220E-05 0.76298590E-09-0.39392284E-13 2
0.82984336E+04-0.15480180E+02 0.10515518E+01 0.25991980E-01 0.23800540E-05 3
-0.19609569E-07 0.93732470E-11 0.10631863E+05 0.21122559E+02 4
CH3CHO L 8/88C 2H 4O 1 G 200.000 6000.000 1000.000 1
0.54041108E+01 0.11723059E-01-0.42263137E-05 0.68372451E-09-0.40984863E-13 2
-0.22593122E+05-0.34807917E+01 0.47294595E+01-0.31932858E-02 0.47534921E-04 3
-0.57458611E-07 0.21931112E-10-0.21572878E+05 0.41030159E+01 4
CH2CHO SAND86O 1H 3C 2 G 250.000 5000.000 1000.000 1
0.05975670E+02 0.08130591E-01-0.02743624E-04 0.04070304E-08-0.02176017E-12 2
0.04903218E+04-0.05045251E+02 0.03409062E+02 0.10738574E-01 0.01891492E-04 3
-0.07158583E-07 0.02867385E-10 0.15214766E+04 0.09558290E+02 4
END

View File

@ -0,0 +1,44 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "chemkin";
object transportProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
".*"
{
transport
{
As 1.512e-06;
Ts 120.;
}
}
"H2"
{
transport
{
As 6.362e-07;
Ts 72.;
}
}
"CO2"
{
transport
{
As 1.572e-06;
Ts 240.;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,46 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object chemistryProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
#includeEtc "caseDicts/solvers/chemistry/TDAC/chemistryPropertiesFlame.cfg"
chemistryType
{
solver ode;
}
chemistry on;
initialChemicalTimeStep 1e-7;
odeCoeffs
{
solver seulex;
absTol 1e-8;
relTol 1e-1;
}
tabulation
{
// Scale factors used in the definition of the ellipsoid of accuracy
scaleFactor
{
Temperature 1000;
}
}
#include "reactionsGRI"
// ************************************************************************* //

View File

@ -0,0 +1,24 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object combustionProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
combustionModel EDC;
EDCCoeffs
{
version v2005;
}
// ************************************************************************* //

View File

@ -0,0 +1,20 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class uniformDimensionedVectorField;
location "constant";
object g;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 1 -2 0 0 0 0];
value (0 0 -9.81);
// ************************************************************************* //

View File

@ -0,0 +1,32 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object momentumTransport;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
simulationType RAS;
RAS
{
model kEpsilon;
kEpsilonCoeffs
{
Prt 0.85;
}
turbulence on;
printCoeffs on;
}
// ************************************************************************* //

View File

@ -0,0 +1,33 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object physicalProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
thermoType
{
type hePsiThermo;
mixture multicomponentMixture;
transport sutherland;
thermo janaf;
energy sensibleEnthalpy;
equationOfState perfectGas;
specie specie;
}
defaultSpecie N2;
#include "thermo.compressibleGasGRI"
// ************************************************************************* //

File diff suppressed because it is too large Load Diff

View File

@ -0,0 +1,208 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
object blockMeshDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
convertToMeters 0.001;
R1X 3.99619288633;
R2X 4.49571699712;
R3X 179.82867988473;
R4X 189.81916210055;
R1Y 0.17447754946;
R2Y 0.19628724314;
R3Y 7.85148972576;
R4Y 8.28768359941;
R1Ym -0.17447754946;
R2Ym -0.19628724314;
R3Ym -7.85148972576;
R4Ym -8.28768359941;
L 1000;
Lm -20;
vertices
(
(0 0 0) // 0
($R1X $R1Y 0) // 1
($R1X $R1Y $L) // 2
(0 0 $L) // 3
($R1X $R1Ym 0) // 4
($R1X $R1Ym $L) // 5
(0 0 $Lm) // 6
($R1X $R1Y $Lm) // 7
($R1X $R1Ym $Lm) // 8
($R2X $R2Y 0) // 9
($R2X $R2Ym 0) // 10
($R2X $R2Y $L) // 11
($R2X $R2Ym $L) // 12
($R3X $R3Y 0) // 13
($R3X $R3Ym 0) // 14
($R3X $R3Y $L) // 15
($R3X $R3Ym $L) // 16
($R2X $R2Y $Lm) // 17
($R3X $R3Y $Lm) // 18
($R3X $R3Ym $Lm) // 19
($R2X $R2Ym $Lm) // 20
($R4X $R4Y 0) // 21
($R4X $R4Ym 0) // 22
($R4X $R4Y $L) // 23
($R4X $R4Ym $L) // 24
);
nFuel 4;
nBurner 1;
nCoflow 30;
nExternal 2;
nLength 90;
nLengthReverse 4;
gradingFuel 1;
gradingCoflow 6;
gradingLength 12.;
gradingLengthInverse 0.5;
blocks
(
// Fuel
hex (6 8 7 6 0 4 1 0) ($nFuel 1 $nLengthReverse)
simpleGrading ($gradingFuel 1 $gradingLengthInverse )
hex (0 4 1 0 3 5 2 3) ($nFuel 1 $nLength)
simpleGrading ($gradingFuel 1 $gradingLength)
// Wall
hex (4 10 9 1 5 12 11 2) ($nBurner 1 $nLength)
simpleGrading (1 1 $gradingLength)
// Coflow
hex (20 19 18 17 10 14 13 9) ($nCoflow 1 $nLengthReverse)
simpleGrading ($gradingCoflow 1 $gradingLengthInverse)
hex (10 14 13 9 12 16 15 11) ($nCoflow 1 $nLength)
simpleGrading ($gradingCoflow 1 $gradingLength)
// External wall
hex (14 22 21 13 16 24 23 15) ($nExternal 1 $nLength)
simpleGrading (1 1 $gradingLength)
);
boundary
(
inletfuel
{
type patch;
faces
(
(6 8 7 6)
);
}
inletair
{
type patch;
faces
(
(19 20 17 18)
);
}
outlet
{
type patch;
faces
(
(5 3 3 2)
(12 11 2 5)
(16 15 11 12)
(15 16 24 23)
);
}
axis
{
type empty;
faces
(
(3 0 0 3)
(0 6 6 0)
);
}
leftside
{
type wall;
faces
(
(14 13 21 22)
(19 18 13 14)
(23 24 22 21)
);
}
burnerwall
{
type wall;
faces
(
(8 7 1 4)
(10 9 17 20)
);
}
burnertip
{
type wall;
faces
(
(4 1 9 10)
);
}
front
{
type wedge;
faces
(
(1 0 3 2)
(7 6 0 1)
(9 1 2 11)
(13 9 11 15)
(18 17 9 13)
(15 23 21 13)
);
}
back
{
type wedge;
faces
(
(5 3 0 4)
(4 0 6 8)
(12 5 4 10)
(16 12 10 14)
(19 14 10 20)
(16 14 22 24)
);
}
);
// ************************************************************************* //

View File

@ -0,0 +1,49 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object controlDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
application foamRun;
solver multicomponentFluid;
startFrom latestTime;
startTime 0;
stopAt endTime;
endTime 10000;
deltaT 1;
writeControl runTime;
writeInterval 1000;
purgeWrite 0;
writeFormat binary;
writePrecision 10;
writeCompression off;
timeFormat general;
timePrecision 6;
runTimeModifiable true;
// ************************************************************************* //

View File

@ -0,0 +1,42 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object decomposeParDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
numberOfSubdomains 6;
method simple;
simpleCoeffs
{
n (1 1 6);
}
hierarchicalCoeffs
{
n ( 1 1 1 );
order xyz;
}
manualCoeffs
{
dataFile "";
}
distributed no;
roots ( );
// ************************************************************************* //

View File

@ -0,0 +1,58 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSchemes;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
ddtSchemes
{
default localEuler;
}
gradSchemes
{
default Gauss linear;
}
divSchemes
{
default none;
div(phi,U) Gauss limitedLinearV 1;
div(phi,Yi) Gauss limitedLinear01 1;
div(phi,h) Gauss limitedLinear 1;
div(phi,K) Gauss limitedLinear 1;
div(phid,p) Gauss limitedLinear 1;
div(phi,epsilon) Gauss limitedLinear 1;
div(phi,Yi_h) Gauss limitedLinear01 1;
div(phi,k) Gauss limitedLinear 1;
div(((rho*nuEff)*dev2(T(grad(U))))) Gauss linear;
}
laplacianSchemes
{
default Gauss linear orthogonal;
}
interpolationSchemes
{
default linear;
}
snGradSchemes
{
default orthogonal;
}
// ************************************************************************* //

View File

@ -0,0 +1,88 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSolution;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
solvers
{
"rho.*"
{
solver diagonal;
}
p
{
solver PCG;
preconditioner DIC;
tolerance 1e-6;
relTol 0.01;
}
pFinal
{
$p;
relTol 0;
}
"(U|h|k|epsilon)"
{
solver PBiCGStab;
preconditioner DILU;
tolerance 1e-6;
relTol 0.1;
}
"(U|h|k|epsilon)Final"
{
$U;
}
"Yi.*"
{
solver PBiCG;
preconditioner DILU;
tolerance 1e-8;
relTol 0.1;
}
}
PIMPLE
{
momentumPredictor yes;
nOuterCorrectors 1;
nCorrectors 2;
nNonOrthogonalCorrectors 0;
maxDeltaT 1e-4;
maxCo 0.25;
alphaTemp 0.05;
alphaY 0.05;
Yref
{
O2 0.1;
CH4 0.1;
}
rDeltaTSmoothingCoeff 0.05;
rDeltaTDampingCoeff 1;
}
relaxationFactors
{
equations
{
".*" 1;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,35 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object setFieldsDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
defaultFieldValues
(
volScalarFieldValue T 292
);
regions
(
boxToCell
{
box (0.002 -0.01 0.005) (0.02 0.01 0.055);
fieldValues
(
volScalarFieldValue T 2200
);
}
);
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CH4;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
inletCH4
{
type fixedValue;
value uniform 0.1561;
}
wallOutside
{
type zeroGradient;
}
wallTube
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0;
}
inletAir
{
type fixedValue;
value uniform 0;
}
outlet
{
type zeroGradient;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CO;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 4.07e-3;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CO2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0.1098;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,43 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object G;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 0 -3 0 0 0 0];
internalField uniform 0;
boundaryField
{
".*"
{
type MarshakRadiation;
T T;
emissivityMode lookup;
emissivity uniform 1.0;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 2.48e-5;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 1.29e-4;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H2O;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0.0942;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object N2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.77;
boundaryField
{
inletCH4
{
type fixedValue;
value uniform 0.6473;
}
wallOutside
{
type zeroGradient;
}
wallTube
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0.7342;
}
inletAir
{
type fixedValue;
value uniform 0.77;
}
outlet
{
type zeroGradient;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object O;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 7.47e-4;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object O2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.23;
boundaryField
{
inletCH4
{
type fixedValue;
value uniform 0.1966;
}
wallOutside
{
type zeroGradient;
}
wallTube
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0.054;
}
inletAir
{
type fixedValue;
value uniform 0.23;
}
outlet
{
type zeroGradient;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object OH;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0.0028;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object T;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 1 0 0 0];
internalField uniform 300;
boundaryField
{
inletCH4
{
type fixedValue;
value uniform 294;
}
wallOutside
{
type zeroGradient;
}
wallTube
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 1880;
}
inletAir
{
type fixedValue;
value uniform 291;
}
outlet
{
type zeroGradient;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,69 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volVectorField;
location "0";
object U;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 1 -1 0 0 0 0];
internalField uniform (0 0 0.9);
boundaryField
{
wallTube
{
type noSlip;
}
outlet
{
type pressureInletOutletVelocity;
value $internalField;
}
inletPilot
{
type fixedValue;
value uniform (0 0 11.4);
}
inletAir
{
type fixedValue;
value uniform (0 0 0.9);
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform (0 0 49.6);
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,68 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object Ydefault;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type fixedValue;
value uniform 0;
}
inletAir
{
type fixedValue;
value uniform 0;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type fixedValue;
value uniform 0;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,73 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object alphat;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type compressible::alphatWallFunction;
Prt 0.85;
value $internalField;
}
outlet
{
type calculated;
value $internalField;
}
inletPilot
{
type calculated;
value $internalField;
}
inletAir
{
type calculated;
value $internalField;
}
wallOutside
{
type compressible::alphatWallFunction;
Prt 0.85;
value $internalField;
}
inletCH4
{
type calculated;
value $internalField;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,83 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object epsilon;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -3 0 0 0 0];
internalField uniform 30000;
boundaryField
{
wallTube
{
type epsilonWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 30000;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type turbulentMixingLengthDissipationRateInlet;
mixingLength 0.000735;
phi phi;
k k;
value uniform 1;
}
inletAir
{
type turbulentMixingLengthDissipationRateInlet;
mixingLength 0.019677;
value uniform 1;
}
wallOutside
{
type epsilonWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value uniform 30000;
}
inletCH4
{
type turbulentMixingLengthDissipationRateInlet;
mixingLength 0.000504;
phi phi;
k k;
value uniform 1;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,73 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object k;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -2 0 0 0 0];
internalField uniform 30;
boundaryField
{
wallTube
{
type kqRWallFunction;
value uniform 30;
}
outlet
{
type zeroGradient;
}
inletPilot
{
type turbulentIntensityKineticEnergyInlet;
intensity 0.0628;
value uniform 1;
}
inletAir
{
type turbulentIntensityKineticEnergyInlet;
intensity 0.0471;
value uniform 1;
}
wallOutside
{
type kqRWallFunction;
value uniform 30;
}
inletCH4
{
type turbulentIntensityKineticEnergyInlet;
intensity 0.0458;
value uniform 1;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,77 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object nut;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
wallTube
{
type nutkWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value $internalField;
}
outlet
{
type calculated;
value $internalField;
}
inletPilot
{
type calculated;
value $internalField;
}
inletAir
{
type calculated;
value $internalField;
}
wallOutside
{
type nutkWallFunction;
Cmu 0.09;
kappa 0.41;
E 9.8;
value $internalField;
}
inletCH4
{
type calculated;
value $internalField;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,66 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object p;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -2 0 0 0 0];
internalField uniform 100000;
boundaryField
{
wallTube
{
type zeroGradient;
}
outlet
{
type totalPressure;
p0 $internalField;
}
inletPilot
{
type zeroGradient;
}
inletAir
{
type zeroGradient;
}
wallOutside
{
type zeroGradient;
}
inletCH4
{
type zeroGradient;
}
frontAndBack_pos
{
type wedge;
}
frontAndBack_neg
{
type wedge;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,36 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/RunFunctions
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/grimech30.dat chemkin/thermo30.dat chemkin/transportProperties \
constant/reactionsGRI constant/thermo.compressibleGasGRI
runApplication blockMesh
runApplication setFields
if ! isTest $@
then
# Run the application without chemistry until 1500 to let the flow develop
runApplication -a foamDictionary -entry "startTime" -set "0" system/controlDict
runApplication -a foamDictionary -entry "writeInterval" -set "1500" system/controlDict
runApplication -a foamDictionary -entry "endTime" -set "1500" system/controlDict
runApplication -a foamDictionary -entry "chemistry" -set "off" constant/chemistryProperties
runApplication $application
# Run with chemistry until flame reach its full size
runApplication -a foamDictionary -entry "startTime" -set "1500" system/controlDict
runApplication -a foamDictionary -entry "writeInterval" -set "100" system/controlDict
runApplication -a foamDictionary -entry "endTime" -set "5000" system/controlDict
runApplication -a foamDictionary -entry "chemistry" -set "on" constant/chemistryProperties
fi
runApplication -o $application
#------------------------------------------------------------------------------

View File

@ -0,0 +1,328 @@
! GRI-Mech Version 3.0 7/30/99 CHEMKIN-II format
! See README30 file at anonymous FTP site unix.sri.com, directory gri;
! WorldWideWeb home page http://www.me.berkeley.edu/gri_mech/ or
! through http://www.gri.org , under 'Basic Research',
! for additional information, contacts, and disclaimer
ELEMENTS
O H C N AR
END
SPECIES
H2 H O O2 OH H2O HO2 H2O2
C CH CH2 CH2(S) CH3 CH4 CO CO2
HCO CH2O CH2OH CH3O CH3OH C2H C2H2 C2H3
C2H4 C2H5 C2H6 HCCO CH2CO HCCOH N2 AR
C3H7 C3H8 CH2CHO CH3CHO
END
!THERMO
! Insert GRI-Mech thermodynamics here or use in default file
!END
REACTIONS
2O+M<=>O2+M 1.200E+17 -1.000 .00
H2/ 2.40/ H2O/15.40/ CH4/ 2.00/ CO/ 1.75/ CO2/ 3.60/ C2H6/ 3.00/ AR/ .83/
O+H+M<=>OH+M 5.000E+17 -1.000 .00
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+H2<=>H+OH 3.870E+04 2.700 6260.00
O+HO2<=>OH+O2 2.000E+13 .000 .00
O+H2O2<=>OH+HO2 9.630E+06 2.000 4000.00
O+CH<=>H+CO 5.700E+13 .000 .00
O+CH2<=>H+HCO 8.000E+13 .000 .00
O+CH2(S)<=>H2+CO 1.500E+13 .000 .00
O+CH2(S)<=>H+HCO 1.500E+13 .000 .00
O+CH3<=>H+CH2O 5.060E+13 .000 .00
O+CH4<=>OH+CH3 1.020E+09 1.500 8600.00
O+CO(+M)<=>CO2(+M) 1.800E+10 .000 2385.00
LOW/ 6.020E+14 .000 3000.00/
H2/2.00/ O2/6.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/3.50/ C2H6/3.00/ AR/ .50/
O+HCO<=>OH+CO 3.000E+13 .000 .00
O+HCO<=>H+CO2 3.000E+13 .000 .00
O+CH2O<=>OH+HCO 3.900E+13 .000 3540.00
O+CH2OH<=>OH+CH2O 1.000E+13 .000 .00
O+CH3O<=>OH+CH2O 1.000E+13 .000 .00
O+CH3OH<=>OH+CH2OH 3.880E+05 2.500 3100.00
O+CH3OH<=>OH+CH3O 1.300E+05 2.500 5000.00
O+C2H<=>CH+CO 5.000E+13 .000 .00
O+C2H2<=>H+HCCO 1.350E+07 2.000 1900.00
O+C2H2<=>OH+C2H 4.600E+19 -1.410 28950.00
O+C2H2<=>CO+CH2 6.940E+06 2.000 1900.00
O+C2H3<=>H+CH2CO 3.000E+13 .000 .00
O+C2H4<=>CH3+HCO 1.250E+07 1.830 220.00
O+C2H5<=>CH3+CH2O 2.240E+13 .000 .00
O+C2H6<=>OH+C2H5 8.980E+07 1.920 5690.00
O+HCCO<=>H+2CO 1.000E+14 .000 .00
O+CH2CO<=>OH+HCCO 1.000E+13 .000 8000.00
O+CH2CO<=>CH2+CO2 1.750E+12 .000 1350.00
O2+CO<=>O+CO2 2.500E+12 .000 47800.00
O2+CH2O<=>HO2+HCO 1.000E+14 .000 40000.00
H+O2+M<=>HO2+M 2.800E+18 -.860 .00
O2/ .00/ H2O/ .00/ CO/ .75/ CO2/1.50/ C2H6/1.50/ N2/ .00/ AR/ .00/
H+2O2<=>HO2+O2 2.080E+19 -1.240 .00
H+O2+H2O<=>HO2+H2O 11.26E+18 -.760 .00
H+O2+N2<=>HO2+N2 2.600E+19 -1.240 .00
H+O2+AR<=>HO2+AR 7.000E+17 -.800 .00
H+O2<=>O+OH 2.650E+16 -.6707 17041.00
2H+M<=>H2+M 1.000E+18 -1.000 .00
H2/ .00/ H2O/ .00/ CH4/2.00/ CO2/ .00/ C2H6/3.00/ AR/ .63/
2H+H2<=>2H2 9.000E+16 -.600 .00
2H+H2O<=>H2+H2O 6.000E+19 -1.250 .00
2H+CO2<=>H2+CO2 5.500E+20 -2.000 .00
H+OH+M<=>H2O+M 2.200E+22 -2.000 .00
H2/ .73/ H2O/3.65/ CH4/2.00/ C2H6/3.00/ AR/ .38/
H+HO2<=>O+H2O 3.970E+12 .000 671.00
H+HO2<=>O2+H2 4.480E+13 .000 1068.00
H+HO2<=>2OH 0.840E+14 .000 635.00
H+H2O2<=>HO2+H2 1.210E+07 2.000 5200.00
H+H2O2<=>OH+H2O 1.000E+13 .000 3600.00
H+CH<=>C+H2 1.650E+14 .000 .00
H+CH2(+M)<=>CH3(+M) 6.000E+14 .000 .00
LOW / 1.040E+26 -2.760 1600.00/
TROE/ .5620 91.00 5836.00 8552.00/
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+CH2(S)<=>CH+H2 3.000E+13 .000 .00
H+CH3(+M)<=>CH4(+M) 13.90E+15 -.534 536.00
LOW / 2.620E+33 -4.760 2440.00/
TROE/ .7830 74.00 2941.00 6964.00 /
H2/2.00/ H2O/6.00/ CH4/3.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+CH4<=>CH3+H2 6.600E+08 1.620 10840.00
H+HCO(+M)<=>CH2O(+M) 1.090E+12 .480 -260.00
LOW / 2.470E+24 -2.570 425.00/
TROE/ .7824 271.00 2755.00 6570.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+HCO<=>H2+CO 7.340E+13 .000 .00
H+CH2O(+M)<=>CH2OH(+M) 5.400E+11 .454 3600.00
LOW / 1.270E+32 -4.820 6530.00/
TROE/ .7187 103.00 1291.00 4160.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2O(+M)<=>CH3O(+M) 5.400E+11 .454 2600.00
LOW / 2.200E+30 -4.800 5560.00/
TROE/ .7580 94.00 1555.00 4200.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2O<=>HCO+H2 5.740E+07 1.900 2742.00
H+CH2OH(+M)<=>CH3OH(+M) 1.055E+12 .500 86.00
LOW / 4.360E+31 -4.650 5080.00/
TROE/ .600 100.00 90000.0 10000.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH2OH<=>H2+CH2O 2.000E+13 .000 .00
H+CH2OH<=>OH+CH3 1.650E+11 .650 -284.00
H+CH2OH<=>CH2(S)+H2O 3.280E+13 -.090 610.00
H+CH3O(+M)<=>CH3OH(+M) 2.430E+12 .515 50.00
LOW / 4.660E+41 -7.440 14080.0/
TROE/ .700 100.00 90000.0 10000.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
H+CH3O<=>H+CH2OH 4.150E+07 1.630 1924.00
H+CH3O<=>H2+CH2O 2.000E+13 .000 .00
H+CH3O<=>OH+CH3 1.500E+12 .500 -110.00
H+CH3O<=>CH2(S)+H2O 2.620E+14 -.230 1070.00
H+CH3OH<=>CH2OH+H2 1.700E+07 2.100 4870.00
H+CH3OH<=>CH3O+H2 4.200E+06 2.100 4870.00
H+C2H(+M)<=>C2H2(+M) 1.000E+17 -1.000 .00
LOW / 3.750E+33 -4.800 1900.00/
TROE/ .6464 132.00 1315.00 5566.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H2(+M)<=>C2H3(+M) 5.600E+12 .000 2400.00
LOW / 3.800E+40 -7.270 7220.00/
TROE/ .7507 98.50 1302.00 4167.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H3(+M)<=>C2H4(+M) 6.080E+12 .270 280.00
LOW / 1.400E+30 -3.860 3320.00/
TROE/ .7820 207.50 2663.00 6095.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H3<=>H2+C2H2 3.000E+13 .000 .00
H+C2H4(+M)<=>C2H5(+M) 0.540E+12 .454 1820.00
LOW / 0.600E+42 -7.620 6970.00/
TROE/ .9753 210.00 984.00 4374.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H4<=>C2H3+H2 1.325E+06 2.530 12240.00
H+C2H5(+M)<=>C2H6(+M) 5.210E+17 -.990 1580.00
LOW / 1.990E+41 -7.080 6685.00/
TROE/ .8422 125.00 2219.00 6882.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C2H5<=>H2+C2H4 2.000E+12 .000 .00
H+C2H6<=>C2H5+H2 1.150E+08 1.900 7530.00
H+HCCO<=>CH2(S)+CO 1.000E+14 .000 .00
H+CH2CO<=>HCCO+H2 5.000E+13 .000 8000.00
H+CH2CO<=>CH3+CO 1.130E+13 .000 3428.00
H+HCCOH<=>H+CH2CO 1.000E+13 .000 .00
H2+CO(+M)<=>CH2O(+M) 4.300E+07 1.500 79600.00
LOW / 5.070E+27 -3.420 84350.00/
TROE/ .9320 197.00 1540.00 10300.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
OH+H2<=>H+H2O 2.160E+08 1.510 3430.00
2OH(+M)<=>H2O2(+M) 7.400E+13 -.370 .00
LOW / 2.300E+18 -.900 -1700.00/
TROE/ .7346 94.00 1756.00 5182.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
2OH<=>O+H2O 3.570E+04 2.400 -2110.00
OH+HO2<=>O2+H2O 1.450E+13 .000 -500.00
DUPLICATE
OH+H2O2<=>HO2+H2O 2.000E+12 .000 427.00
DUPLICATE
OH+H2O2<=>HO2+H2O 1.700E+18 .000 29410.00
DUPLICATE
OH+C<=>H+CO 5.000E+13 .000 .00
OH+CH<=>H+HCO 3.000E+13 .000 .00
OH+CH2<=>H+CH2O 2.000E+13 .000 .00
OH+CH2<=>CH+H2O 1.130E+07 2.000 3000.00
OH+CH2(S)<=>H+CH2O 3.000E+13 .000 .00
OH+CH3(+M)<=>CH3OH(+M) 2.790E+18 -1.430 1330.00
LOW / 4.000E+36 -5.920 3140.00/
TROE/ .4120 195.0 5900.00 6394.00/
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
OH+CH3<=>CH2+H2O 5.600E+07 1.600 5420.00
OH+CH3<=>CH2(S)+H2O 6.440E+17 -1.340 1417.00
OH+CH4<=>CH3+H2O 1.000E+08 1.600 3120.00
OH+CO<=>H+CO2 4.760E+07 1.228 70.00
OH+HCO<=>H2O+CO 5.000E+13 .000 .00
OH+CH2O<=>HCO+H2O 3.430E+09 1.180 -447.00
OH+CH2OH<=>H2O+CH2O 5.000E+12 .000 .00
OH+CH3O<=>H2O+CH2O 5.000E+12 .000 .00
OH+CH3OH<=>CH2OH+H2O 1.440E+06 2.000 -840.00
OH+CH3OH<=>CH3O+H2O 6.300E+06 2.000 1500.00
OH+C2H<=>H+HCCO 2.000E+13 .000 .00
OH+C2H2<=>H+CH2CO 2.180E-04 4.500 -1000.00
OH+C2H2<=>H+HCCOH 5.040E+05 2.300 13500.00
OH+C2H2<=>C2H+H2O 3.370E+07 2.000 14000.00
OH+C2H2<=>CH3+CO 4.830E-04 4.000 -2000.00
OH+C2H3<=>H2O+C2H2 5.000E+12 .000 .00
OH+C2H4<=>C2H3+H2O 3.600E+06 2.000 2500.00
OH+C2H6<=>C2H5+H2O 3.540E+06 2.120 870.00
OH+CH2CO<=>HCCO+H2O 7.500E+12 .000 2000.00
2HO2<=>O2+H2O2 1.300E+11 .000 -1630.00
DUPLICATE
2HO2<=>O2+H2O2 4.200E+14 .000 12000.00
DUPLICATE
HO2+CH2<=>OH+CH2O 2.000E+13 .000 .00
HO2+CH3<=>O2+CH4 1.000E+12 .000 .00
HO2+CH3<=>OH+CH3O 3.780E+13 .000 .00
HO2+CO<=>OH+CO2 1.500E+14 .000 23600.00
HO2+CH2O<=>HCO+H2O2 5.600E+06 2.000 12000.00
C+O2<=>O+CO 5.800E+13 .000 576.00
C+CH2<=>H+C2H 5.000E+13 .000 .00
C+CH3<=>H+C2H2 5.000E+13 .000 .00
CH+O2<=>O+HCO 6.710E+13 .000 .00
CH+H2<=>H+CH2 1.080E+14 .000 3110.00
CH+H2O<=>H+CH2O 5.710E+12 .000 -755.00
CH+CH2<=>H+C2H2 4.000E+13 .000 .00
CH+CH3<=>H+C2H3 3.000E+13 .000 .00
CH+CH4<=>H+C2H4 6.000E+13 .000 .00
CH+CO(+M)<=>HCCO(+M) 5.000E+13 .000 .00
LOW / 2.690E+28 -3.740 1936.00/
TROE/ .5757 237.00 1652.00 5069.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH+CO2<=>HCO+CO 1.900E+14 .000 15792.00
CH+CH2O<=>H+CH2CO 9.460E+13 .000 -515.00
CH+HCCO<=>CO+C2H2 5.000E+13 .000 .00
CH2+O2=>OH+H+CO 5.000E+12 .000 1500.00
CH2+H2<=>H+CH3 5.000E+05 2.000 7230.00
2CH2<=>H2+C2H2 1.600E+15 .000 11944.00
CH2+CH3<=>H+C2H4 4.000E+13 .000 .00
CH2+CH4<=>2CH3 2.460E+06 2.000 8270.00
CH2+CO(+M)<=>CH2CO(+M) 8.100E+11 .500 4510.00
LOW / 2.690E+33 -5.110 7095.00/
TROE/ .5907 275.00 1226.00 5185.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH2+HCCO<=>C2H3+CO 3.000E+13 .000 .00
CH2(S)+N2<=>CH2+N2 1.500E+13 .000 600.00
CH2(S)+AR<=>CH2+AR 9.000E+12 .000 600.00
CH2(S)+O2<=>H+OH+CO 2.800E+13 .000 .00
CH2(S)+O2<=>CO+H2O 1.200E+13 .000 .00
CH2(S)+H2<=>CH3+H 7.000E+13 .000 .00
CH2(S)+H2O(+M)<=>CH3OH(+M) 4.820E+17 -1.160 1145.00
LOW / 1.880E+38 -6.360 5040.00/
TROE/ .6027 208.00 3922.00 10180.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
CH2(S)+H2O<=>CH2+H2O 3.000E+13 .000 .00
CH2(S)+CH3<=>H+C2H4 1.200E+13 .000 -570.00
CH2(S)+CH4<=>2CH3 1.600E+13 .000 -570.00
CH2(S)+CO<=>CH2+CO 9.000E+12 .000 .00
CH2(S)+CO2<=>CH2+CO2 7.000E+12 .000 .00
CH2(S)+CO2<=>CO+CH2O 1.400E+13 .000 .00
CH2(S)+C2H6<=>CH3+C2H5 4.000E+13 .000 -550.00
CH3+O2<=>O+CH3O 3.560E+13 .000 30480.00
CH3+O2<=>OH+CH2O 2.310E+12 .000 20315.00
CH3+H2O2<=>HO2+CH4 2.450E+04 2.470 5180.00
2CH3(+M)<=>C2H6(+M) 6.770E+16 -1.180 654.00
LOW / 3.400E+41 -7.030 2762.00/
TROE/ .6190 73.20 1180.00 9999.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
2CH3<=>H+C2H5 6.840E+12 .100 10600.00
CH3+HCO<=>CH4+CO 2.648E+13 .000 .00
CH3+CH2O<=>HCO+CH4 3.320E+03 2.810 5860.00
CH3+CH3OH<=>CH2OH+CH4 3.000E+07 1.500 9940.00
CH3+CH3OH<=>CH3O+CH4 1.000E+07 1.500 9940.00
CH3+C2H4<=>C2H3+CH4 2.270E+05 2.000 9200.00
CH3+C2H6<=>C2H5+CH4 6.140E+06 1.740 10450.00
HCO+H2O<=>H+CO+H2O 1.500E+18 -1.000 17000.00
HCO+M<=>H+CO+M 1.870E+17 -1.000 17000.00
H2/2.00/ H2O/ .00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/
HCO+O2<=>HO2+CO 13.45E+12 .000 400.00
CH2OH+O2<=>HO2+CH2O 1.800E+13 .000 900.00
CH3O+O2<=>HO2+CH2O 4.280E-13 7.600 -3530.00
C2H+O2<=>HCO+CO 1.000E+13 .000 -755.00
C2H+H2<=>H+C2H2 5.680E+10 0.900 1993.00
C2H3+O2<=>HCO+CH2O 4.580E+16 -1.390 1015.00
C2H4(+M)<=>H2+C2H2(+M) 8.000E+12 .440 86770.00
LOW / 1.580E+51 -9.300 97800.00/
TROE/ .7345 180.00 1035.00 5417.00 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
C2H5+O2<=>HO2+C2H4 8.400E+11 .000 3875.00
HCCO+O2<=>OH+2CO 3.200E+12 .000 854.00
2HCCO<=>2CO+C2H2 1.000E+13 .000 .00
O+CH3=>H+H2+CO 3.370E+13 .000 .00
O+C2H4<=>H+CH2CHO 6.700E+06 1.830 220.00
O+C2H5<=>H+CH3CHO 1.096E+14 .000 .00
OH+HO2<=>O2+H2O 0.500E+16 .000 17330.00
DUPLICATE
OH+CH3=>H2+CH2O 8.000E+09 .500 -1755.00
CH+H2(+M)<=>CH3(+M) 1.970E+12 .430 -370.00
LOW/ 4.820E+25 -2.80 590.0 /
TROE/ .578 122.0 2535.0 9365.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
CH2+O2=>2H+CO2 5.800E+12 .000 1500.00
CH2+O2<=>O+CH2O 2.400E+12 .000 1500.00
CH2+CH2=>2H+C2H2 2.000E+14 .000 10989.00
CH2(S)+H2O=>H2+CH2O 6.820E+10 .250 -935.00
C2H3+O2<=>O+CH2CHO 3.030E+11 .290 11.00
C2H3+O2<=>HO2+C2H2 1.337E+06 1.610 -384.00
O+CH3CHO<=>OH+CH2CHO 2.920E+12 .000 1808.00
O+CH3CHO=>OH+CH3+CO 2.920E+12 .000 1808.00
O2+CH3CHO=>HO2+CH3+CO 3.010E+13 .000 39150.00
H+CH3CHO<=>CH2CHO+H2 2.050E+09 1.160 2405.00
H+CH3CHO=>CH3+H2+CO 2.050E+09 1.160 2405.00
OH+CH3CHO=>CH3+H2O+CO 2.343E+10 0.730 -1113.00
HO2+CH3CHO=>CH3+H2O2+CO 3.010E+12 .000 11923.00
CH3+CH3CHO=>CH3+CH4+CO 2.720E+06 1.770 5920.00
H+CH2CO(+M)<=>CH2CHO(+M) 4.865E+11 0.422 -1755.00
LOW/ 1.012E+42 -7.63 3854.0/
TROE/ 0.465 201.0 1773.0 5333.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+CH2CHO=>H+CH2+CO2 1.500E+14 .000 .00
O2+CH2CHO=>OH+CO+CH2O 1.810E+10 .000 .00
O2+CH2CHO=>OH+2HCO 2.350E+10 .000 .00
H+CH2CHO<=>CH3+HCO 2.200E+13 .000 .00
H+CH2CHO<=>CH2CO+H2 1.100E+13 .000 .00
OH+CH2CHO<=>H2O+CH2CO 1.200E+13 .000 .00
OH+CH2CHO<=>HCO+CH2OH 3.010E+13 .000 .00
CH3+C2H5(+M)<=>C3H8(+M) .9430E+13 .000 .00
LOW/ 2.710E+74 -16.82 13065.0 /
TROE/ .1527 291.0 2742.0 7748.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+C3H8<=>OH+C3H7 1.930E+05 2.680 3716.00
H+C3H8<=>C3H7+H2 1.320E+06 2.540 6756.00
OH+C3H8<=>C3H7+H2O 3.160E+07 1.800 934.00
C3H7+H2O2<=>HO2+C3H8 3.780E+02 2.720 1500.00
CH3+C3H8<=>C3H7+CH4 0.903E+00 3.650 7154.00
CH3+C2H4(+M)<=>C3H7(+M) 2.550E+06 1.600 5700.00
LOW/ 3.00E+63 -14.6 18170./
TROE/ .1894 277.0 8748.0 7891.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
O+C3H7<=>C2H5+CH2O 9.640E+13 .000 .00
H+C3H7(+M)<=>C3H8(+M) 3.613E+13 .000 .00
LOW/ 4.420E+61 -13.545 11357.0/
TROE/ .315 369.0 3285.0 6667.0 /
H2/2.00/ H2O/6.00/ CH4/2.00/ CO/1.50/ CO2/2.00/ C2H6/3.00/ AR/ .70/
H+C3H7<=>CH3+C2H5 4.060E+06 2.190 890.00
OH+C3H7<=>C2H5+CH2OH 2.410E+13 .000 .00
HO2+C3H7<=>O2+C3H8 2.550E+10 0.255 -943.00
HO2+C3H7=>OH+C2H5+CH2O 2.410E+13 .000 .00
CH3+C3H7<=>2C2H5 1.927E+13 -0.320 .00
END

View File

@ -0,0 +1,218 @@
THERMO ALL
250.000 1000.000 5000.000
! GRI-Mech Version 3.0 Thermodynamics released 7/30/99
! NASA Polynomial format for CHEMKIN-II
! see README file for disclaimer
O L 1/90O 1 G 200.000 3500.000 1000.000 1
2.56942078E+00-8.59741137E-05 4.19484589E-08-1.00177799E-11 1.22833691E-15 2
2.92175791E+04 4.78433864E+00 3.16826710E+00-3.27931884E-03 6.64306396E-06 3
-6.12806624E-09 2.11265971E-12 2.91222592E+04 2.05193346E+00 4
O2 TPIS89O 2 G 200.000 3500.000 1000.000 1
3.28253784E+00 1.48308754E-03-7.57966669E-07 2.09470555E-10-2.16717794E-14 2
-1.08845772E+03 5.45323129E+00 3.78245636E+00-2.99673416E-03 9.84730201E-06 3
-9.68129509E-09 3.24372837E-12-1.06394356E+03 3.65767573E+00 4
H L 7/88H 1 G 200.000 3500.000 1000.000 1
2.50000001E+00-2.30842973E-11 1.61561948E-14-4.73515235E-18 4.98197357E-22 2
2.54736599E+04-4.46682914E-01 2.50000000E+00 7.05332819E-13-1.99591964E-15 3
2.30081632E-18-9.27732332E-22 2.54736599E+04-4.46682853E-01 4
H2 TPIS78H 2 G 200.000 3500.000 1000.000 1
3.33727920E+00-4.94024731E-05 4.99456778E-07-1.79566394E-10 2.00255376E-14 2
-9.50158922E+02-3.20502331E+00 2.34433112E+00 7.98052075E-03-1.94781510E-05 3
2.01572094E-08-7.37611761E-12-9.17935173E+02 6.83010238E-01 4
OH RUS 78O 1H 1 G 200.000 3500.000 1000.000 1
3.09288767E+00 5.48429716E-04 1.26505228E-07-8.79461556E-11 1.17412376E-14 2
3.85865700E+03 4.47669610E+00 3.99201543E+00-2.40131752E-03 4.61793841E-06 3
-3.88113333E-09 1.36411470E-12 3.61508056E+03-1.03925458E-01 4
H2O L 8/89H 2O 1 G 200.000 3500.000 1000.000 1
3.03399249E+00 2.17691804E-03-1.64072518E-07-9.70419870E-11 1.68200992E-14 2
-3.00042971E+04 4.96677010E+00 4.19864056E+00-2.03643410E-03 6.52040211E-06 3
-5.48797062E-09 1.77197817E-12-3.02937267E+04-8.49032208E-01 4
HO2 L 5/89H 1O 2 G 200.000 3500.000 1000.000 1
4.01721090E+00 2.23982013E-03-6.33658150E-07 1.14246370E-10-1.07908535E-14 2
1.11856713E+02 3.78510215E+00 4.30179801E+00-4.74912051E-03 2.11582891E-05 3
-2.42763894E-08 9.29225124E-12 2.94808040E+02 3.71666245E+00 4
H2O2 L 7/88H 2O 2 G 200.000 3500.000 1000.000 1
4.16500285E+00 4.90831694E-03-1.90139225E-06 3.71185986E-10-2.87908305E-14 2
-1.78617877E+04 2.91615662E+00 4.27611269E+00-5.42822417E-04 1.67335701E-05 3
-2.15770813E-08 8.62454363E-12-1.77025821E+04 3.43505074E+00 4
C L11/88C 1 G 200.000 3500.000 1000.000 1
2.49266888E+00 4.79889284E-05-7.24335020E-08 3.74291029E-11-4.87277893E-15 2
8.54512953E+04 4.80150373E+00 2.55423955E+00-3.21537724E-04 7.33792245E-07 3
-7.32234889E-10 2.66521446E-13 8.54438832E+04 4.53130848E+00 4
CH TPIS79C 1H 1 G 200.000 3500.000 1000.000 1
2.87846473E+00 9.70913681E-04 1.44445655E-07-1.30687849E-10 1.76079383E-14 2
7.10124364E+04 5.48497999E+00 3.48981665E+00 3.23835541E-04-1.68899065E-06 3
3.16217327E-09-1.40609067E-12 7.07972934E+04 2.08401108E+00 4
CH2 L S/93C 1H 2 G 200.000 3500.000 1000.000 1
2.87410113E+00 3.65639292E-03-1.40894597E-06 2.60179549E-10-1.87727567E-14 2
4.62636040E+04 6.17119324E+00 3.76267867E+00 9.68872143E-04 2.79489841E-06 3
-3.85091153E-09 1.68741719E-12 4.60040401E+04 1.56253185E+00 4
CH2(S) L S/93C 1H 2 G 200.000 3500.000 1000.000 1
2.29203842E+00 4.65588637E-03-2.01191947E-06 4.17906000E-10-3.39716365E-14 2
5.09259997E+04 8.62650169E+00 4.19860411E+00-2.36661419E-03 8.23296220E-06 3
-6.68815981E-09 1.94314737E-12 5.04968163E+04-7.69118967E-01 4
CH3 L11/89C 1H 3 G 200.000 3500.000 1000.000 1
2.28571772E+00 7.23990037E-03-2.98714348E-06 5.95684644E-10-4.67154394E-14 2
1.67755843E+04 8.48007179E+00 3.67359040E+00 2.01095175E-03 5.73021856E-06 3
-6.87117425E-09 2.54385734E-12 1.64449988E+04 1.60456433E+00 4
CH4 L 8/88C 1H 4 G 200.000 3500.000 1000.000 1
7.48514950E-02 1.33909467E-02-5.73285809E-06 1.22292535E-09-1.01815230E-13 2
-9.46834459E+03 1.84373180E+01 5.14987613E+00-1.36709788E-02 4.91800599E-05 3
-4.84743026E-08 1.66693956E-11-1.02466476E+04-4.64130376E+00 4
CO TPIS79C 1O 1 G 200.000 3500.000 1000.000 1
2.71518561E+00 2.06252743E-03-9.98825771E-07 2.30053008E-10-2.03647716E-14 2
-1.41518724E+04 7.81868772E+00 3.57953347E+00-6.10353680E-04 1.01681433E-06 3
9.07005884E-10-9.04424499E-13-1.43440860E+04 3.50840928E+00 4
CO2 L 7/88C 1O 2 G 200.000 3500.000 1000.000 1
3.85746029E+00 4.41437026E-03-2.21481404E-06 5.23490188E-10-4.72084164E-14 2
-4.87591660E+04 2.27163806E+00 2.35677352E+00 8.98459677E-03-7.12356269E-06 3
2.45919022E-09-1.43699548E-13-4.83719697E+04 9.90105222E+00 4
HCO L12/89H 1C 1O 1 G 200.000 3500.000 1000.000 1
2.77217438E+00 4.95695526E-03-2.48445613E-06 5.89161778E-10-5.33508711E-14 2
4.01191815E+03 9.79834492E+00 4.22118584E+00-3.24392532E-03 1.37799446E-05 3
-1.33144093E-08 4.33768865E-12 3.83956496E+03 3.39437243E+00 4
CH2O L 8/88H 2C 1O 1 G 200.000 3500.000 1000.000 1
1.76069008E+00 9.20000082E-03-4.42258813E-06 1.00641212E-09-8.83855640E-14 2
-1.39958323E+04 1.36563230E+01 4.79372315E+00-9.90833369E-03 3.73220008E-05 3
-3.79285261E-08 1.31772652E-11-1.43089567E+04 6.02812900E-01 4
CH2OH GUNL93C 1H 3O 1 G 200.000 3500.000 1000.000 1
3.69266569E+00 8.64576797E-03-3.75101120E-06 7.87234636E-10-6.48554201E-14 2
-3.24250627E+03 5.81043215E+00 3.86388918E+00 5.59672304E-03 5.93271791E-06 3
-1.04532012E-08 4.36967278E-12-3.19391367E+03 5.47302243E+00 4
CH3O 121686C 1H 3O 1 G 250.00 3000.00 1000.000 1
0.03770799E+02 0.07871497E-01-0.02656384E-04 0.03944431E-08-0.02112616E-12 2
0.12783252E+03 0.02929575E+02 0.02106204E+02 0.07216595E-01 0.05338472E-04 3
-0.07377636E-07 0.02075610E-10 0.09786011E+04 0.13152177E+02 4
CH3OH L 8/88C 1H 4O 1 G 200.000 3500.000 1000.000 1
1.78970791E+00 1.40938292E-02-6.36500835E-06 1.38171085E-09-1.17060220E-13 2
-2.53748747E+04 1.45023623E+01 5.71539582E+00-1.52309129E-02 6.52441155E-05 3
-7.10806889E-08 2.61352698E-11-2.56427656E+04-1.50409823E+00 4
C2H L 1/91C 2H 1 G 200.000 3500.000 1000.000 1
3.16780652E+00 4.75221902E-03-1.83787077E-06 3.04190252E-10-1.77232770E-14 2
6.71210650E+04 6.63589475E+00 2.88965733E+00 1.34099611E-02-2.84769501E-05 3
2.94791045E-08-1.09331511E-11 6.68393932E+04 6.22296438E+00 4
C2H2 L 1/91C 2H 2 G 200.000 3500.000 1000.000 1
4.14756964E+00 5.96166664E-03-2.37294852E-06 4.67412171E-10-3.61235213E-14 2
2.59359992E+04-1.23028121E+00 8.08681094E-01 2.33615629E-02-3.55171815E-05 3
2.80152437E-08-8.50072974E-12 2.64289807E+04 1.39397051E+01 4
C2H3 L 2/92C 2H 3 G 200.000 3500.000 1000.000 1
3.01672400E+00 1.03302292E-02-4.68082349E-06 1.01763288E-09-8.62607041E-14 2
3.46128739E+04 7.78732378E+00 3.21246645E+00 1.51479162E-03 2.59209412E-05 3
-3.57657847E-08 1.47150873E-11 3.48598468E+04 8.51054025E+00 4
C2H4 L 1/91C 2H 4 G 200.000 3500.000 1000.000 1
2.03611116E+00 1.46454151E-02-6.71077915E-06 1.47222923E-09-1.25706061E-13 2
4.93988614E+03 1.03053693E+01 3.95920148E+00-7.57052247E-03 5.70990292E-05 3
-6.91588753E-08 2.69884373E-11 5.08977593E+03 4.09733096E+00 4
C2H5 L12/92C 2H 5 G 200.000 3500.000 1000.000 1
1.95465642E+00 1.73972722E-02-7.98206668E-06 1.75217689E-09-1.49641576E-13 2
1.28575200E+04 1.34624343E+01 4.30646568E+00-4.18658892E-03 4.97142807E-05 3
-5.99126606E-08 2.30509004E-11 1.28416265E+04 4.70720924E+00 4
C2H6 L 8/88C 2H 6 G 200.000 3500.000 1000.000 1
1.07188150E+00 2.16852677E-02-1.00256067E-05 2.21412001E-09-1.90002890E-13 2
-1.14263932E+04 1.51156107E+01 4.29142492E+00-5.50154270E-03 5.99438288E-05 3
-7.08466285E-08 2.68685771E-11-1.15222055E+04 2.66682316E+00 4
CH2CO L 5/90C 2H 2O 1 G 200.000 3500.000 1000.000 1
4.51129732E+00 9.00359745E-03-4.16939635E-06 9.23345882E-10-7.94838201E-14 2
-7.55105311E+03 6.32247205E-01 2.13583630E+00 1.81188721E-02-1.73947474E-05 3
9.34397568E-09-2.01457615E-12-7.04291804E+03 1.22156480E+01 4
HCCO SRIC91H 1C 2O 1 G 250.00 4000.00 1000.000 1
0.56282058E+01 0.40853401E-02-0.15934547E-05 0.28626052E-09-0.19407832E-13 2
0.19327215E+05-0.39302595E+01 0.22517214E+01 0.17655021E-01-0.23729101E-04 3
0.17275759E-07-0.50664811E-11 0.20059449E+05 0.12490417E+02 4
HCCOH SRI91C 2O 1H 2 G 250.000 5000.000 1000.000 1
0.59238291E+01 0.67923600E-02-0.25658564E-05 0.44987841E-09-0.29940101E-13 2
0.72646260E+04-0.76017742E+01 0.12423733E+01 0.31072201E-01-0.50866864E-04 3
0.43137131E-07-0.14014594E-10 0.80316143E+04 0.13874319E+02 4
H2CN 41687H 2C 1N 1 G 250.00 4000.000 1000.000 1
0.52097030E+01 0.29692911E-02-0.28555891E-06-0.16355500E-09 0.30432589E-13 2
0.27677109E+05-0.44444780E+01 0.28516610E+01 0.56952331E-02 0.10711400E-05 3
-0.16226120E-08-0.23511081E-12 0.28637820E+05 0.89927511E+01 4
HCN GRI/98H 1C 1N 1 G 200.000 6000.000 1000.000 1
0.38022392E+01 0.31464228E-02-0.10632185E-05 0.16619757E-09-0.97997570E-14 2
0.14407292E+05 0.15754601E+01 0.22589886E+01 0.10051170E-01-0.13351763E-04 3
0.10092349E-07-0.30089028E-11 0.14712633E+05 0.89164419E+01 4
HNO And93 H 1N 1O 1 G 200.000 6000.000 1000.000 1
0.29792509E+01 0.34944059E-02-0.78549778E-06 0.57479594E-10-0.19335916E-15 2
0.11750582E+05 0.86063728E+01 0.45334916E+01-0.56696171E-02 0.18473207E-04 3
-0.17137094E-07 0.55454573E-11 0.11548297E+05 0.17498417E+01 4
N L 6/88N 1 G 200.000 6000.000 1000.000 1
0.24159429E+01 0.17489065E-03-0.11902369E-06 0.30226245E-10-0.20360982E-14 2
0.56133773E+05 0.46496096E+01 0.25000000E+01 0.00000000E+00 0.00000000E+00 3
0.00000000E+00 0.00000000E+00 0.56104637E+05 0.41939087E+01 4
NNH T07/93N 2H 1 G 200.000 6000.000 1000.000 1
0.37667544E+01 0.28915082E-02-0.10416620E-05 0.16842594E-09-0.10091896E-13 2
0.28650697E+05 0.44705067E+01 0.43446927E+01-0.48497072E-02 0.20059459E-04 3
-0.21726464E-07 0.79469539E-11 0.28791973E+05 0.29779410E+01 4
N2O L 7/88N 2O 1 G 200.000 6000.000 1000.000 1
0.48230729E+01 0.26270251E-02-0.95850874E-06 0.16000712E-09-0.97752303E-14 2
0.80734048E+04-0.22017207E+01 0.22571502E+01 0.11304728E-01-0.13671319E-04 3
0.96819806E-08-0.29307182E-11 0.87417744E+04 0.10757992E+02 4
NH And94 N 1H 1 G 200.000 6000.000 1000.000 1
0.27836928E+01 0.13298430E-02-0.42478047E-06 0.78348501E-10-0.55044470E-14 2
0.42120848E+05 0.57407799E+01 0.34929085E+01 0.31179198E-03-0.14890484E-05 3
0.24816442E-08-0.10356967E-11 0.41880629E+05 0.18483278E+01 4
NH2 And89 N 1H 2 G 200.000 6000.000 1000.000 1
0.28347421E+01 0.32073082E-02-0.93390804E-06 0.13702953E-09-0.79206144E-14 2
0.22171957E+05 0.65204163E+01 0.42040029E+01-0.21061385E-02 0.71068348E-05 3
-0.56115197E-08 0.16440717E-11 0.21885910E+05-0.14184248E+00 4
NH3 J 6/77N 1H 3 G 200.000 6000.000 1000.000 1
0.26344521E+01 0.56662560E-02-0.17278676E-05 0.23867161E-09-0.12578786E-13 2
-0.65446958E+04 0.65662928E+01 0.42860274E+01-0.46605230E-02 0.21718513E-04 3
-0.22808887E-07 0.82638046E-11-0.67417285E+04-0.62537277E+00 4
NO RUS 78N 1O 1 G 200.000 6000.000 1000.000 1
0.32606056E+01 0.11911043E-02-0.42917048E-06 0.69457669E-10-0.40336099E-14 2
0.99209746E+04 0.63693027E+01 0.42184763E+01-0.46389760E-02 0.11041022E-04 3
-0.93361354E-08 0.28035770E-11 0.98446230E+04 0.22808464E+01 4
NO2 L 7/88N 1O 2 G 200.000 6000.000 1000.000 1
0.48847542E+01 0.21723956E-02-0.82806906E-06 0.15747510E-09-0.10510895E-13 2
0.23164983E+04-0.11741695E+00 0.39440312E+01-0.15854290E-02 0.16657812E-04 3
-0.20475426E-07 0.78350564E-11 0.28966179E+04 0.63119917E+01 4
HCNO BDEA94H 1N 1C 1O 1G 250.000 5000.000 1382.000 1
6.59860456E+00 3.02778626E-03-1.07704346E-06 1.71666528E-10-1.01439391E-14 2
1.79661339E+04-1.03306599E+01 2.64727989E+00 1.27505342E-02-1.04794236E-05 3
4.41432836E-09-7.57521466E-13 1.92990252E+04 1.07332972E+01 4
HOCN BDEA94H 1N 1C 1O 1G 250.000 5000.000 1368.000 1
5.89784885E+00 3.16789393E-03-1.11801064E-06 1.77243144E-10-1.04339177E-14 2
-3.70653331E+03-6.18167825E+00 3.78604952E+00 6.88667922E-03-3.21487864E-06 3
5.17195767E-10 1.19360788E-14-2.82698400E+03 5.63292162E+00 4
HNCO BDEA94H 1N 1C 1O 1G 250.000 5000.000 1478.000 1
6.22395134E+00 3.17864004E-03-1.09378755E-06 1.70735163E-10-9.95021955E-15 2
-1.66599344E+04-8.38224741E+00 3.63096317E+00 7.30282357E-03-2.28050003E-06 3
-6.61271298E-10 3.62235752E-13-1.55873636E+04 6.19457727E+00 4
NCO EA 93 N 1C 1O 1 G 200.000 6000.000 1000.000 1
0.51521845E+01 0.23051761E-02-0.88033153E-06 0.14789098E-09-0.90977996E-14 2
0.14004123E+05-0.25442660E+01 0.28269308E+01 0.88051688E-02-0.83866134E-05 3
0.48016964E-08-0.13313595E-11 0.14682477E+05 0.95504646E+01 4
CN HBH92 C 1N 1 G 200.000 6000.000 1000.000 1
0.37459805E+01 0.43450775E-04 0.29705984E-06-0.68651806E-10 0.44134173E-14 2
0.51536188E+05 0.27867601E+01 0.36129351E+01-0.95551327E-03 0.21442977E-05 3
-0.31516323E-09-0.46430356E-12 0.51708340E+05 0.39804995E+01 4
HCNN SRI/94C 1N 2H 1 G 250.000 5000.000 1000.000 1
0.58946362E+01 0.39895959E-02-0.15982380E-05 0.29249395E-09-0.20094686E-13 2
0.53452941E+05-0.51030502E+01 0.25243194E+01 0.15960619E-01-0.18816354E-04 3
0.12125540E-07-0.32357378E-11 0.54261984E+05 0.11675870E+02 4
N2 121286N 2 G 250.000 5000.000 1000.000 1
0.02926640E+02 0.14879768E-02-0.05684760E-05 0.10097038E-09-0.06753351E-13 2
-0.09227977E+04 0.05980528E+02 0.03298677E+02 0.14082404E-02-0.03963222E-04 3
0.05641515E-07-0.02444854E-10-0.10208999E+04 0.03950372E+02 4
AR 120186AR 1 G 250.000 5000.000 1000.000 1
0.02500000E+02 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 2
-0.07453750E+04 0.04366000E+02 0.02500000E+02 0.00000000E+00 0.00000000E+00 3
0.00000000E+00 0.00000000E+00-0.07453750E+04 0.04366000E+02 4
C3H8 L 4/85C 3H 8 G 250.000 5000.000 1000.000 1
0.75341368E+01 0.18872239E-01-0.62718491E-05 0.91475649E-09-0.47838069E-13 2
-0.16467516E+05-0.17892349E+02 0.93355381E+00 0.26424579E-01 0.61059727E-05 3
-0.21977499E-07 0.95149253E-11-0.13958520E+05 0.19201691E+02 4
C3H7 L 9/84C 3H 7 G 250.000 5000.000 1000.000 1
0.77026987E+01 0.16044203E-01-0.52833220E-05 0.76298590E-09-0.39392284E-13 2
0.82984336E+04-0.15480180E+02 0.10515518E+01 0.25991980E-01 0.23800540E-05 3
-0.19609569E-07 0.93732470E-11 0.10631863E+05 0.21122559E+02 4
CH3CHO L 8/88C 2H 4O 1 G 200.000 6000.000 1000.000 1
0.54041108E+01 0.11723059E-01-0.42263137E-05 0.68372451E-09-0.40984863E-13 2
-0.22593122E+05-0.34807917E+01 0.47294595E+01-0.31932858E-02 0.47534921E-04 3
-0.57458611E-07 0.21931112E-10-0.21572878E+05 0.41030159E+01 4
CH2CHO SAND86O 1H 3C 2 G 250.000 5000.000 1000.000 1
0.05975670E+02 0.08130591E-01-0.02743624E-04 0.04070304E-08-0.02176017E-12 2
0.04903218E+04-0.05045251E+02 0.03409062E+02 0.10738574E-01 0.01891492E-04 3
-0.07158583E-07 0.02867385E-10 0.15214766E+04 0.09558290E+02 4
END

View File

@ -0,0 +1,44 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "chemkin";
object transportProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
".*"
{
transport
{
As 1.512e-06;
Ts 120.;
}
}
"H2"
{
transport
{
As 6.362e-07;
Ts 72.;
}
}
"CO2"
{
transport
{
As 1.572e-06;
Ts 240.;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,46 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object chemistryProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
#includeEtc "caseDicts/solvers/chemistry/TDAC/chemistryPropertiesFlame.cfg"
chemistryType
{
solver ode;
}
chemistry on;
initialChemicalTimeStep 1e-7;
odeCoeffs
{
solver seulex;
absTol 1e-8;
relTol 1e-1;
}
tabulation
{
// Scale factors used in the definition of the ellipsoid of accuracy
scaleFactor
{
Temperature 1000;
}
}
#include "reactionsGRI"
// ************************************************************************* //

View File

@ -0,0 +1,24 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object combustionProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
combustionModel EDC;
EDCCoeffs
{
version v2005;
}
// ************************************************************************* //

View File

@ -0,0 +1,23 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object fvModels;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
radiation
{
type radiation;
libs ("libradiationModels.so");
}
// ************************************************************************* //

View File

@ -0,0 +1,20 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class uniformDimensionedVectorField;
location "constant";
object g;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 1 -2 0 0 0 0];
value (0 0 -9.81);
// ************************************************************************* //

View File

@ -0,0 +1,27 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object momentumTransport;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
simulationType RAS;
RAS
{
model kEpsilon;
turbulence on;
printCoeffs on;
}
// ************************************************************************* //

View File

@ -0,0 +1,32 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object physicalProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
thermoType
{
type hePsiThermo;
mixture multicomponentMixture;
transport sutherland;
thermo janaf;
energy sensibleEnthalpy;
equationOfState perfectGas;
specie specie;
}
defaultSpecie N2;
#include "thermo.compressibleGasGRI"
// ************************************************************************* //

View File

@ -0,0 +1,175 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object radiationProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
radiation on;
radiationModel P1;
// Number of flow iterations per radiation iteration
solverFreq 1;
absorptionEmissionModel greyMeanCombustion;
greyMeanCombustionCoeffs
{
lookUpTableFileName none;
EhrrCoeff 0.0;
CO2
{
Tcommon 200; // Common Temp
invTemp true; // Is the polynomial using inverse temperature.
Tlow 200; // Low Temp
Thigh 2500; // High Temp
loTcoeffs // coefss for T < Tcommon
(
0 // a0 +
0 // a1*T +
0 // a2*T^(+/-)2 +
0 // a3*T^(+/-)3 +
0 // a4*T^(+/-)4 +
0 // a5*T^(+/-)5 +
);
hiTcoeffs // coefss for T > Tcommon
(
18.741
-121.31e3
273.5e6
-194.05e9
56.31e12
-5.8169e15
);
}
H2O
{
Tcommon 200;
invTemp true;
Tlow 200;
Thigh 2500;
loTcoeffs
(
0
0
0
0
0
0
);
hiTcoeffs
(
-0.23093
-1.12390e3
9.4153e6
-2.99885e9
0.51382e12
-1.868e10
);
}
CH4
{
Tcommon 200;
Tlow 200;
Thigh 2500;
invTemp false;
loTcoeffs
(
0
0
0
0
0
0
);
hiTcoeffs
(
6.6334
-0.0035686
1.6682e-8
2.5611e-10
-2.6558e-14
0
);
}
O2
{
Tcommon 200;
invTemp true;
Tlow 200;
Thigh 2500;
loTcoeffs
(
0
0
0
0
0
0
);
hiTcoeffs
(
0.1
0
0
0
0
0
);
}
N2
{
Tcommon 200;
invTemp true;
Tlow 200;
Thigh 2500;
loTcoeffs
(
0
0
0
0
0
0
);
hiTcoeffs
(
0.1
0
0
0
0
0
);
}
}
scatterModel none;
sootModel none;
// ************************************************************************* //

File diff suppressed because it is too large Load Diff

View File

@ -0,0 +1,175 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
object blockMeshDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
convertToMeters 0.001;
vertices
(
(0 0 -100) // 0
(3.6 -0.15717942211764708 -100) // 1
(3.6 0.15717942211764708 -100) // 2
(3.85 -0.168094659764705905 -100) // 3
(3.85 0.168094659764705905 -100) // 4
(9.1 -0.39731465035294123 -100) // 5
(9.1 0.39731465035294123 -100) // 6
(0 0 0) // 7
(3.6 -0.15717942211764708 0) // 8
(3.6 0.15717942211764708 0) // 9
(3.85 -0.168094659764705905 0) // 10
(3.85 0.168094659764705905 0) // 11
(9.1 -0.39731465035294123 0) // 12
(9.1 0.39731465035294123 0) // 13
(150 -6.549142588235295 0) // 14
(150 6.549142588235295 0) // 15
(0 0 500) // 16
(3.6 -0.15717942211764708 500) // 17
(3.6 0.15717942211764708 500) // 18
(3.85 -0.168094659764705905 500) // 19
(3.85 0.168094659764705905 500) // 20
(9.1 -0.39731465035294123 500) // 21
(9.1 0.39731465035294123 500) // 22
(150 -6.549142588235295 500) // 23
(150 6.549142588235295 500) // 24
);
blocks
(
hex ( 0 1 2 0 7 8 9 7) (5 1 20) simpleGrading (1 1 1)
hex ( 3 5 6 4 10 12 13 11) (5 1 20) simpleGrading (1 1 1)
hex ( 7 8 9 7 16 17 18 16) (5 1 70) simpleGrading (1 1 2)
hex ( 8 10 11 9 17 19 20 18) (1 1 70) simpleGrading (1 1 2)
hex (10 12 13 11 19 21 22 20) (5 1 70) simpleGrading (1 1 2)
hex (12 14 15 13 21 23 24 22) (60 1 70) simpleGrading (3 1 2)
);
boundary
(
inletCH4
{
type patch;
faces
(
(1 0 0 2)
);
}
wallOutside
{
type wall;
faces
(
(14 15 24 23)
);
}
wallTube
{
type wall;
faces
(
(1 2 9 8)
(10 11 9 8)
(4 3 10 11)
(5 6 13 12)
);
}
inletPilot
{
type patch;
faces
(
(5 3 4 6)
);
}
inletAir
{
type patch;
faces
(
(14 12 13 15)
);
}
outlet
{
type patch;
faces
(
(16 17 18 16)
(17 19 20 18)
(19 21 22 20)
(21 22 24 23)
);
}
axis
{
type empty;
faces
(
(0 7 7 0)
(7 16 16 7)
);
}
frontAndBack_pos
{
type wedge;
faces
(
(2 0 7 9)
(6 4 11 13)
(9 7 16 18)
(11 9 18 20)
(13 11 20 22)
(15 13 22 24)
);
}
frontAndBack_neg
{
type wedge;
faces
(
(0 1 8 7)
(3 5 12 10)
(7 8 17 16)
(8 10 19 17)
(10 12 21 19)
(12 14 23 21)
);
}
);
// ************************************************************************* //

View File

@ -0,0 +1,51 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
version 2;
format ascii;
class dictionary;
location "system";
object controlDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
application foamRun;
solver multicomponentFluid;
startFrom startTime;
startTime 0;
stopAt endTime;
endTime 1500;
deltaT 1;
writeControl runTime;
writeInterval 1500;
purgeWrite 0;
writeFormat binary;
writePrecision 10;
writeCompression off;
timeFormat general;
timePrecision 6;
runTimeModifiable true;
// ************************************************************************* //

View File

@ -0,0 +1,58 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSchemes;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
ddtSchemes
{
default localEuler;
}
gradSchemes
{
default Gauss linear;
}
divSchemes
{
default none;
div(phi,U) Gauss limitedLinearV 1;
div(phi,Yi) Gauss limitedLinear01 1;
div(phi,h) Gauss limitedLinear 1;
div(phi,K) Gauss limitedLinear 1;
div(phid,p) Gauss limitedLinear 1;
div(phi,epsilon) Gauss limitedLinear 1;
div(phi,Yi_h) Gauss limitedLinear01 1;
div(phi,k) Gauss limitedLinear 1;
div(((rho*nuEff)*dev2(T(grad(U))))) Gauss linear;
}
laplacianSchemes
{
default Gauss linear orthogonal;
}
interpolationSchemes
{
default linear;
}
snGradSchemes
{
default orthogonal;
}
// ************************************************************************* //

View File

@ -0,0 +1,102 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSolution;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
solvers
{
"rho.*"
{
solver diagonal;
}
p
{
solver PCG;
preconditioner DIC;
tolerance 1e-6;
relTol 0.01;
}
pFinal
{
$p;
relTol 0;
}
"(U|h|k|epsilon)"
{
solver PBiCGStab;
preconditioner DILU;
tolerance 1e-6;
relTol 0.1;
}
"(U|h|k|epsilon)Final"
{
$U;
}
"Yi.*"
{
solver PBiCGStab;
preconditioner DILU;
tolerance 1e-8;
relTol 0.1;
}
"G.*"
{
solver PCG;
preconditioner DIC;
tolerance 1e-5;
relTol 0.1;
}
GFinal
{
$G;
relTol 0;
}
}
PIMPLE
{
momentumPredictor yes;
nOuterCorrectors 1;
nCorrectors 2;
nNonOrthogonalCorrectors 0;
maxDeltaT 1e-4;
maxCo 0.25;
alphaTemp 0.05;
alphaY 0.05;
Yref
{
O2 0.1;
CH4 0.1;
}
rDeltaTSmoothingCoeff 0.025;
rDeltaTDampingCoeff 1;
}
relaxationFactors
{
equations
{
".*" 1;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,40 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object setFieldsDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
defaultFieldValues
(
volScalarFieldValue T 300
volScalarFieldValue N2 0.77
volScalarFieldValue O2 0.23
volScalarFieldValue CH4 0
);
regions
(
boxToCell
{
box (0 -10 -100) (0.0036 10 0);
fieldValues
(
volScalarFieldValue CH4 0.1561
volScalarFieldValue O2 0.1966
volScalarFieldValue N2 0.6473
);
}
);
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object N2;
}
// ************************************************************************* //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.766;
boundaryField
{
walls
{
type zeroGradient;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object O2;
}
// ************************************************************************* //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.234;
boundaryField
{
walls
{
type zeroGradient;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,31 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class volScalarField;
location "0";
object Qdot;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -3 0 0 0 0];
internalField uniform 0;
boundaryField
{
walls
{
type calculated;
value uniform 0;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object T;
}
// ************************************************************************* //
dimensions [0 0 0 1 0 0 0];
internalField uniform 800;
boundaryField
{
walls
{
type zeroGradient;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,29 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volVectorField;
object U;
}
// ************************************************************************* //
dimensions [0 1 -1 0 0 0 0];
internalField uniform (0 0 0);
boundaryField
{
walls
{
type fixedValue;
value uniform (0 0 0);
}
}
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object Ydefault;
}
// ************************************************************************* //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
walls
{
type zeroGradient;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,31 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class volScalarField;
location "0";
object alphat;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [1 -1 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
walls
{
type compressible::alphatWallFunction;
value uniform 0;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,31 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class volScalarField;
location "0";
object epsilon;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -3 0 0 0 0];
internalField uniform 90;
boundaryField
{
walls
{
type epsilonWallFunction;
value uniform 90;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,31 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class volScalarField;
location "0";
object k;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -2 0 0 0 0];
internalField uniform 1;
boundaryField
{
walls
{
type kqRWallFunction;
value uniform 1;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,31 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class volScalarField;
location "0";
object nut;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 2 -1 0 0 0 0];
internalField uniform 0;
boundaryField
{
walls
{
type nutkWallFunction;
value uniform 0;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
object p;
}
// ************************************************************************* //
dimensions [1 -1 -2 0 0 0 0];
internalField uniform 5e+06;
boundaryField
{
walls
{
type zeroGradient;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,11 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/CleanFunctions
cleanCase
rm -rf constant/reactions constant/speciesThermo
#------------------------------------------------------------------------------

View File

@ -0,0 +1,17 @@
#!/bin/sh
cd ${0%/*} || exit 1 # Run from this directory
# Source tutorial run functions
. $WM_PROJECT_DIR/bin/tools/RunFunctions
# Set application name
application=$(getApplication)
runApplication chemkinToFoam \
chemkin/chem.inp chemkin/therm.dat chemkin/transportProperties \
constant/reactions constant/speciesThermo
runApplication blockMesh
runApplication $application
#------------------------------------------------------------------------------

View File

@ -0,0 +1,11 @@
ELEMENTS
H O C N AR
END
SPECIE
C7H16 O2 N2 CO2 H2O
END
REACTIONS
C7H16 + 11O2 => 7CO2 + 8H2O 5.00E+8 0.0 15780.0! 1
FORD / C7H16 0.25 /
FORD / O2 1.5 /
END

View File

@ -0,0 +1,23 @@
THERMO ALL
200.000 1000.000 6000.000
C7H16 P10/85C 7.H 16. 0. 0.G 200.000 6000.000 1000. 1
2.04565203E+01 3.48575357E-02-1.09226846E-05 1.67201776E-09-9.81024850E-14 2
-3.25556365E+04-8.04405017E+01 1.11532994E+01-9.49419773E-03 1.95572075E-04 3
-2.49753662E-07 9.84877715E-11-2.67688904E+04-1.59096837E+01-2.25846141E+04 4
O2 ATcT06O 2. 0. 0. 0.G 200.000 6000.000 1000. 1
3.45852381E+00 1.04045351E-03-2.79664041E-07 3.11439672E-11-8.55656058E-16 2
1.02229063E+04 4.15264119E+00 3.78535371E+00-3.21928540E-03 1.12323443E-05 3
-1.17254068E-08 4.17659585E-12 1.02922572E+04 3.27320239E+00 1.13558105E+04 4
N2 G 8/02N 2. 0. 0. 0.G 200.000 6000.000 1000. 1
2.95257637E+00 1.39690040E-03-4.92631603E-07 7.86010195E-11-4.60755204E-15 2
-9.23948688E+02 5.87188762E+00 3.53100528E+00-1.23660988E-04-5.02999433E-07 3
2.43530612E-09-1.40881235E-12-1.04697628E+03 2.96747038E+00 0.00000000E+00 4
CO2 L 7/88C 1O 2 0 0G 200.000 6000.000 1000. 1
0.46365111E+01 0.27414569E-02-0.99589759E-06 0.16038666E-09-0.91619857E-14 2
-0.49024904E+05-0.19348955E+01 0.23568130E+01 0.89841299E-02-0.71220632E-05 3
0.24573008E-08-0.14288548E-12-0.48371971E+05 0.99009035E+01-0.47328105E+05 4
H2O L 5/89H 2O 1 0 0G 200.000 6000.000 1000. 1
0.26770389E+01 0.29731816E-02-0.77376889E-06 0.94433514E-10-0.42689991E-14 2
-0.29885894E+05 0.68825500E+01 0.41986352E+01-0.20364017E-02 0.65203416E-05 3
-0.54879269E-08 0.17719680E-11-0.30293726E+05-0.84900901E+00-0.29084817E+05 4
END

View File

@ -0,0 +1,26 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "chemkin";
object transportProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
".*"
{
transport
{
As 1.67212e-6;
Ts 170.672;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,34 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object chemistryProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
chemistryType
{
solver ode;
}
chemistry on;
initialChemicalTimeStep 1e-07;
odeCoeffs
{
solver seulex;
eps 0.05;
}
#include "reactions"
// ************************************************************************* //

View File

@ -0,0 +1,234 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class dictionary;
location "constant";
object cloudProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
type sprayCloud;
solution
{
coupled true;
transient yes;
cellValueSourceCorrection on;
maxCo 0.3;
sourceTerms
{
schemes
{
rho explicit 1;
U explicit 1;
Yi explicit 1;
h explicit 1;
radiation explicit 1;
}
}
interpolationSchemes
{
rho cell;
U cellPoint;
thermo:mu cell;
T cell;
Cp cell;
thermo:kappa cell;
p cell;
}
integrationSchemes
{
U Euler;
T analytical;
}
}
constantProperties
{
T0 320;
// place holders for rho0 and Cp0
// - reset from liquid properties using T0
rho0 1000;
Cp0 4187;
constantVolume false;
}
subModels
{
particleForces
{
sphereDrag;
}
injectionModels
{
model1
{
type coneInjection;
SOI 0;
massTotal 6.0e-6;
parcelBasisType mass;
injectionMethod disc;
flowType flowRateAndDischarge;
dInner 0;
dOuter 1.9e-4;
duration 1.25e-3;
position (0 0.0995 0);
direction (0 -1 0);
parcelsPerSecond 20000000;
flowRateProfile table
(
(0 0.1272)
(4.16667e-05 6.1634)
(8.33333e-05 9.4778)
(0.000125 9.5806)
(0.000166667 9.4184)
(0.000208333 9.0926)
(0.00025 8.7011)
(0.000291667 8.2239)
(0.000333333 8.0401)
(0.000375 8.8450)
(0.000416667 8.9174)
(0.000458333 8.8688)
(0.0005 8.8882)
(0.000541667 8.6923)
(0.000583333 8.0014)
(0.000625 7.2582)
(0.000666667 7.2757)
(0.000708333 6.9680)
(0.00075 6.7608)
(0.000791667 6.6502)
(0.000833333 6.7695)
(0.000875 5.5774)
(0.000916667 4.8649)
(0.000958333 5.0805)
(0.001 4.9547)
(0.00104167 4.5613)
(0.00108333 4.4536)
(0.001125 5.2651)
(0.00116667 5.2560)
(0.00120833 5.1737)
(0.00125 3.9213)
(0.001251 0.0000)
(1000 0.0000)
);
Cd constant 0.9;
thetaInner constant 0.0;
thetaOuter constant 10.0;
sizeDistribution
{
type RosinRammler;
RosinRammlerDistribution
{
minValue 1e-06;
maxValue 0.00015;
d 0.00015;
n 3;
}
}
}
}
dispersionModel none;
patchInteractionModel standardWallInteraction;
heatTransferModel RanzMarshall;
compositionModel singlePhaseMixture;
phaseChangeModel liquidEvaporationBoil;
surfaceFilmModel none;
atomisationModel none;
breakupModel ReitzDiwakar; // ReitzKHRT;
stochasticCollisionModel none;
radiation off;
standardWallInteractionCoeffs
{
type rebound;
}
RanzMarshallCoeffs
{
BirdCorrection true;
}
singlePhaseMixtureCoeffs
{
phases
(
liquid
{
C7H16 1;
}
);
}
liquidEvaporationBoilCoeffs
{
enthalpyTransfer enthalpyDifference;
activeLiquids ( C7H16 );
}
ReitzDiwakarCoeffs
{
solveOscillationEq yes;
Cbag 6;
Cb 0.785;
Cstrip 0.5;
Cs 10;
}
/*
ReitzKHRTCoeffs
{
solveOscillationEq yes;
B0 0.61;
B1 40;
Ctau 1;
CRT 0.1;
msLimit 0.2;
WeberLimit 6;
}
*/
TABCoeffs
{
y0 0;
yDot0 0;
Cmu 10;
Comega 8;
WeCrit 12;
}
}
cloudFunctions
{}
// ************************************************************************* //

View File

@ -0,0 +1,25 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object combustionProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
combustionModel PaSR;
PaSRCoeffs
{
Cmix 1.0;
}
// ************************************************************************* //

View File

@ -0,0 +1,28 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object fvModels;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
buoyancyForce
{
type buoyancyForce;
}
clouds
{
type clouds;
libs ("liblagrangianParcel.so");
}
// ************************************************************************* //

View File

@ -0,0 +1,21 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class uniformDimensionedVectorField;
location "constant";
object g;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 1 -2 0 0 0 0];
value (0 -9.81 0);
// ************************************************************************* //

View File

@ -0,0 +1,29 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format binary;
class dictionary;
location "constant";
object momentumTransport;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
simulationType RAS;
RAS
{
model kEpsilon;
turbulence on;
printCoeffs on;
}
// ************************************************************************* //

View File

@ -0,0 +1,42 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "constant";
object physicalProperties;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
thermoType
{
type heRhoThermo;
mixture multicomponentMixture;
transport sutherland;
thermo janaf;
energy sensibleEnthalpy;
equationOfState perfectGas;
specie specie;
}
#include "speciesThermo"
newFormat yes;
defaultSpecie N2;
liquids
{
C7H16;
}
solids
{}
// ************************************************************************* //

View File

@ -0,0 +1,53 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
object blockMeshDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
convertToMeters 0.001;
vertices
(
(-10 0 -10)
(-10 0 10)
(10 0 10)
(10 0 -10)
(-10 100 -10)
(-10 100 10)
(10 100 10)
(10 100 -10)
);
blocks
(
hex (0 1 2 3 4 5 6 7) (41 41 100) simpleGrading (1 1 1)
);
boundary
(
walls
{
type wall;
faces
(
(2 6 5 1)
(0 4 7 3)
(0 1 5 4)
(4 5 6 7)
(7 6 2 3)
(3 2 1 0)
);
}
);
// ************************************************************************* //

View File

@ -0,0 +1,59 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object controlDict;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
application foamRun;
solver multicomponentFluid;
startFrom startTime;
startTime 0;
stopAt endTime;
endTime 0.01;
deltaT 2.5e-06;
writeControl adjustableRunTime;
writeInterval 5e-05;
purgeWrite 0;
writeFormat binary;
writePrecision 6;
writeCompression off;
timeFormat general;
timePrecision 6;
adjustTimeStep yes;
maxCo 0.1;
runTimeModifiable yes;
functions
{
#includeFunc Qdot
}
// ************************************************************************* //

View File

@ -0,0 +1,57 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSchemes;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
ddtSchemes
{
default Euler;
}
gradSchemes
{
default Gauss linear;
}
divSchemes
{
default none;
div(phi,U) Gauss upwind;
div(phid,p) Gauss upwind;
div(phi,K) Gauss linear;
div(phi,k) Gauss upwind;
div(phi,epsilon) Gauss upwind;
div(U) Gauss linear;
div(((rho*nuEff)*dev2(T(grad(U))))) Gauss linear;
div(phi,Yi_h) Gauss upwind;
}
laplacianSchemes
{
default Gauss linear orthogonal;
}
interpolationSchemes
{
default linear;
}
snGradSchemes
{
default orthogonal;
}
// ************************************************************************* //

View File

@ -0,0 +1,95 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class dictionary;
location "system";
object fvSolution;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
solvers
{
rho
{
solver PCG;
preconditioner DIC;
tolerance 1e-05;
relTol 0.1;
}
rhoFinal
{
$rho;
tolerance 1e-05;
relTol 0;
}
"(U|k|epsilon)"
{
solver smoothSolver;
smoother symGaussSeidel;
tolerance 1e-06;
relTol 0.1;
}
p
{
solver GAMG;
tolerance 0;
relTol 0.1;
smoother GaussSeidel;
}
pFinal
{
$p;
tolerance 1e-06;
relTol 0;
}
"(U|k|epsilon)Final"
{
$U;
tolerance 1e-06;
relTol 0;
}
"(h|Yi|O2|N2|H2O)"
{
solver PBiCGStab;
preconditioner DILU;
tolerance 1e-6;
relTol 0.1;
}
"(h|Yi|O2|N2|H2O)Final"
{
$Yi;
relTol 0;
}
}
PIMPLE
{
transonic no;
nCorrectors 2;
nNonOrthogonalCorrectors 0;
momentumPredictor yes;
}
relaxationFactors
{
equations
{
".*" 1;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,47 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CH4;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0.0;
boundaryField
{
fuel
{
type fixedValue;
value uniform 1.0;
}
air
{
type fixedValue;
value uniform 0.0;
}
outlet
{
type inletOutlet;
inletValue uniform 0.0;
value uniform 0.0;
}
frontAndBack
{
type empty;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,47 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object CO2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
fuel
{
type fixedValue;
value uniform 0;
}
air
{
type fixedValue;
value uniform 0;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
frontAndBack
{
type empty;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,47 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object H2O;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
fuel
{
type fixedValue;
value uniform 0;
}
air
{
type fixedValue;
value uniform 0;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
frontAndBack
{
type empty;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,47 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object N2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 1;
boundaryField
{
fuel
{
type fixedValue;
value uniform 0.0;
}
air
{
type fixedValue;
value uniform 0.77;
}
outlet
{
type inletOutlet;
inletValue uniform 1;
value uniform 1;
}
frontAndBack
{
type empty;
}
}
// ************************************************************************* //

View File

@ -0,0 +1,46 @@
/*--------------------------------*- C++ -*----------------------------------*\
========= |
\\ / F ield | OpenFOAM: The Open Source CFD Toolbox
\\ / O peration | Website: https://openfoam.org
\\ / A nd | Version: dev
\\/ M anipulation |
\*---------------------------------------------------------------------------*/
FoamFile
{
format ascii;
class volScalarField;
location "0";
object O2;
}
// * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * //
dimensions [0 0 0 0 0 0 0];
internalField uniform 0;
boundaryField
{
fuel
{
type fixedValue;
value uniform 0.0;
}
air
{
type fixedValue;
value uniform 0.23;
}
outlet
{
type inletOutlet;
inletValue uniform 0;
value uniform 0;
}
frontAndBack
{
type empty;
}
}
// ************************************************************************* //

Some files were not shown because too many files have changed in this diff Show More