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Sum of mass fractions is zero for species 6(NO NH3 O2 CO2 N2 H2O) |
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January 28, 2021, 09:20 |
Sum of mass fractions is zero for species 6(NO NH3 O2 CO2 N2 H2O)
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Join Date: Mar 2020
Posts: 23
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Hello.
I am trying to do simulation of the gas-solid fluidized bed catalytic reactor. For this purpose I use tutorial reactingTwoPhaseEulerFoam--->laminar--->fluidisedBed. However, since it does not contain any files responsible for chemistry, I use chemistry files from combustion tutorial--->chemFoam--->h2. Of course I have modified them according to my case (reaction, species, conditions). When I start simulation I get the ERROR described below, however it seems that I have defined the mole fractions for species. You can find the files responsible for chemistry attached to this thread. Please, if someone knows how to overcome this issue, give me your advice. Thank you for your help!!! Best, Davyd. /*---------------------------------------------------------------------------*\ | ========= | | | \\ / F ield | OpenFOAM: The Open Source CFD Toolbox | | \\ / O peration | Version: v1912 | | \\ / A nd | Website: www.openfoam.com | | \\/ M anipulation | | \*---------------------------------------------------------------------------*/ Build : _f3950763fe-20191219 OPENFOAM=1912 Arch : "LSB;label=32;scalar=64" Exec : reactingTwoPhaseEulerFoam Date : Jan 28 2021 Time : 15:44:49 Host : LAPTOP-LTH2ON9V PID : 1922 I/O : uncollated Case : /mnt/c/Users/David/Downloads/OpenFOAM/OpenFOAM-v1912/RUN/fluidisedBed_REACTING_comb_h2 nProcs : 1 trapFpe: Floating point exception trapping enabled (FOAM_SIGFPE). fileModificationChecking : Monitoring run-time modified files using timeStampMaster (fileModificationSkew 10) allowSystemOperations : Allowing user-supplied system call operations // * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * * // Create time Create mesh for time = 0 PIMPLE: no residual control data found. Calculations will employ 3 corrector loops Reading g Reading hRef Creating phaseSystem Selecting twoPhaseSystem interfaceCompositionPhaseChangeTwoPhaseSystem Selecting phaseModel for particles: purePhaseModel Selecting diameterModel for phase particles: constant Selecting thermodynamics package { type heRhoThermo; mixture pureMixture; transport const; thermo hConst; equationOfState rhoConst; specie specie; energy sensibleInternalEnergy; } Calculating face flux field phi.particles Selecting turbulence model type RAS Selecting RAS turbulence model phasePressure phasePressureCoeffs { preAlphaExp 500; expMax 1000; alphaMax 0.62; g0 1000; } Selecting phaseModel for air: reactingPhaseModel Selecting diameterModel for phase air: isothermal Selecting thermodynamics package { type heRhoThermo; mixture reactingMixture; transport sutherland; thermo janaf; equationOfState perfectGas; specie specie; energy sensibleEnthalpy; } Selecting chemistryReader chemkinReader --> FOAM FATAL ERROR: Sum of mass fractions is zero for species 6(NO NH3 O2 CO2 N2 H2O) From function void Foam::multiComponentMixture<ThermoType>::correctMa ssFractions() [with ThermoType = Foam::sutherlandTransport<Foam::species::thermo<Fo am::janafThermo<Foam:erfectGas<Foam::specie> >, Foam::sensibleEnthalpy> >] in file lnInclude/multiComponentMixture.C at line 64. FOAM exiting |
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