2528df0f75
These changes make it unnecessary to copy header files around during the build process, which tends to confuse IDEs and debuggers. The headers which comprise Cantera's external C++ interface are now in the 'include' directory. All of the samples and demos are now in the 'samples' subdirectory.
266 lines
7.9 KiB
C++
266 lines
7.9 KiB
C++
#include <cantera/Cantera.h>
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#include <cantera/onedim.h>
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#include <cantera/IdealGasMix.h>
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#include <cantera/equilibrium.h>
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#include <cantera/transport.h>
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using namespace Cantera;
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int flamespeed(int np, void* p)
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{
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try {
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int i;
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IdealGasMix gas("gri30.cti","gri30_mix");
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doublereal temp = 300.0; // K
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doublereal pressure = 1.0*OneAtm; //atm
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doublereal uin=0.3; //m/sec
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gas.setState_TPX(temp, pressure, "CH4:1.0, O2:2.0, N2:7.52");
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int nsp = gas.nSpecies();
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vector_fp x;
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x.resize(nsp);
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double phi = 0.0;
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if (np > 0) {
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phi = *(double*)(p);
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}
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if (phi == 0.0) {
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cout << "Enter phi: ";
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cin >> phi;
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}
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doublereal C_atoms=1.0;
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doublereal H_atoms=4.0;
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doublereal ax=C_atoms+H_atoms/4.0;
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doublereal fa_stoic=1.0/(4.76*ax);
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for (int k=0; k<nsp; k++) {
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if (k==gas.speciesIndex("CH4")) {
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x[k]=1.0;
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} else if (k==gas.speciesIndex("O2")) {
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x[k]=0.21/phi/fa_stoic;
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} else if (k==gas.speciesIndex("N2")) {
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x[k]=0.79/phi/fa_stoic;
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} else {
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x[k]=0.0;
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}
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}
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gas.setState_TPX(temp,pressure,DATA_PTR(x));
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doublereal rho_in=gas.density();
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double* yin=new double[nsp];
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gas.getMassFractions(yin);
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try {
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equilibrate(gas,"HP");
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} catch (CanteraError) {
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showErrors(cout);
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}
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double* yout=new double[nsp];
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gas.getMassFractions(yout);
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doublereal rho_out = gas.density();
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doublereal Tad=gas.temperature();
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cout << phi<<' '<<Tad<<endl;
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//double Tin=temp;
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//double Tout=Tad;
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//double breakpt=0.2;
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//============= build each domain ========================
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//-------- step 1: create the flow -------------
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//AxiStagnFlow flow(&gas);
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FreeFlame flow(&gas);
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// create an initial grid
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int nz=5;
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doublereal lz=0.02;
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doublereal* z=new double[nz+1];
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doublereal dz=lz/((doublereal)(nz-1));
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for (int iz=0; iz<nz; iz++) {
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z[iz]=((doublereal)iz)*dz;
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}
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//add one node onto end of domain to help with zero gradient at outlet
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z[nz]=lz*1.05;
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nz++;
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flow.setupGrid(nz, z);
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// specify the objects to use to compute kinetic rates and
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// transport properties
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Transport* trmix = newTransportMgr("Mix", &gas);
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Transport* trmulti = newTransportMgr("Multi", &gas);
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flow.setTransport(*trmix);
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flow.setKinetics(gas);
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flow.setPressure(pressure);
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//------- step 2: create the inlet -----------------------
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Inlet1D inlet;
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inlet.setMoleFractions(DATA_PTR(x));
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doublereal mdot=uin*rho_in;
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inlet.setMdot(mdot);
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inlet.setTemperature(temp);
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//------- step 3: create the outlet ---------------------
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Outlet1D outlet;
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//=================== create the container and insert the domains =====
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vector<Domain1D*> domains;
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domains.push_back(&inlet);
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domains.push_back(&flow);
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domains.push_back(&outlet);
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// OneDim flamesim(domains);
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Sim1D flame(domains);
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//----------- Supply initial guess----------------------
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vector_fp locs;
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vector_fp value;
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locs.resize(3);
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value.resize(3);
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//ramp values from inlet to adiabatic flame conditions
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// over 70% of domain and then level off at equilibrium
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double z1=0.7;
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double uout;
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uout=inlet.mdot()/rho_out;
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uin=inlet.mdot()/rho_in;
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locs[0]=0.0;
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locs[1]=z1;
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locs[2]=1.0;
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value[0]=uin;
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value[1]=uout;
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value[2]=uout;
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flame.setInitialGuess("u",locs,value);
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value[0]=temp;
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value[1]=Tad;
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value[2]=Tad;
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flame.setInitialGuess("T",locs,value);
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for (i=0; i<nsp; i++) {
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value[0]=yin[i];
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value[1]=yout[i];
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value[2]=yout[i];
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flame.setInitialGuess(gas.speciesName(i),locs,value);
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}
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inlet.setMoleFractions(DATA_PTR(x));
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inlet.setMdot(mdot);
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inlet.setTemperature(temp);
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flame.showSolution();
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int flowdomain=1;
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double ratio=10.0;
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double slope=0.2;
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double curve=0.02;
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double prune=-0.00005;
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flame.setRefineCriteria(flowdomain,ratio,slope,curve,prune);
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int loglevel=1;
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bool refine_grid = true;
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/* Solve species*/
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//flow.fixTemperature();
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//refine_grid=false;
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//flame.solve(loglevel,refine_grid);
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/* Solve freely propagating flame*/
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/* Linearally interpolate to find location where this
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temperature would exist. The temperature at this
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location will then be fixed for remainder of
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calculation.*/
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flow.fixTemperature();
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refine_grid=false;
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flame.setFixedTemperature(900.0);
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// flame.setAdiabaticFlame();
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flame.solve(loglevel,refine_grid);
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refine_grid = true;
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flow.solveEnergyEqn();
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flame.solve(loglevel,refine_grid);
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double flameSpeed_mix = flame.value(flowdomain,flow.componentIndex("u"),0);
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cout << "Flame speed with mixture-averaged transport: " <<
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flame.value(flowdomain,flow.componentIndex("u"),0) << " m/s" << endl;
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// now switch to multicomponent transport
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flow.setTransport(*trmulti);
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flame.solve(loglevel, refine_grid);
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double flameSpeed_multi = flame.value(flowdomain,flow.componentIndex("u"),0);
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cout << "Flame speed with multicomponent transport: " <<
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flame.value(flowdomain,flow.componentIndex("u"),0) << " m/s" << endl;
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// now enable Soret diffusion
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flow.enableSoret(true);
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flame.solve(loglevel, refine_grid);
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double flameSpeed_full = flame.value(flowdomain,flow.componentIndex("u"),0);
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cout << "Flame speed with multicomponent transport + Soret: " <<
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flame.value(flowdomain,flow.componentIndex("u"),0) << " m/s" << endl;
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int np=flow.nPoints();
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vector<doublereal> zvec,Tvec,COvec,CO2vec,Uvec;
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printf("\n%9s\t%8s\t%5s\t%7s\n","z (m)", "T (K)", "U (m/s)", "Y(CO)");
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for (int n=0; n<np; n++) {
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Tvec.push_back(flame.value(flowdomain,flow.componentIndex("T"),n));
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COvec.push_back(flame.value(flowdomain,flow.componentIndex("CO"),n));
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CO2vec.push_back(flame.value(flowdomain,flow.componentIndex("CO2"),n));
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Uvec.push_back(flame.value(flowdomain,flow.componentIndex("u"),n));
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zvec.push_back(flow.grid(n));
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printf("%9.6f\t%8.3f\t%5.3f\t%7.5f\n",flow.grid(n),Tvec[n],Uvec[n],COvec[n]);
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}
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cout << endl<<"Adiabatic flame temperature from equilibrium is: "<<Tad<<endl;
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cout << "Flame speed for phi="<<phi<<" is "<<Uvec[0]<<" m/s."<<endl;
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string reportFile = "flamespeed.csv";
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FILE* FP = fopen(reportFile.c_str(), "w");
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if (!FP) {
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printf("Failure to open file\n");
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exit(-1);
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}
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fprintf(FP," Flame speed (mixture-averaged ) = %11.3e m/s\n", flameSpeed_mix);
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fprintf(FP," Flame speed (multicomponent ) = %11.3e m/s\n", flameSpeed_multi);
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fprintf(FP," Flame speed (multicomponent + Soret) = %11.3e m/s\n", flameSpeed_full);
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fprintf(FP," Grid, Temperature, Uvec, CO, CO2\n");
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for (int n = 0; n < np; n++) {
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fprintf(FP," %11.3e, %11.3e, %11.3e, %11.3e, %11.3e\n",
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flow.grid(n), Tvec[n], Uvec[n], COvec[n], CO2vec[n]);
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}
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fclose(FP);
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return 0;
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} catch (CanteraError) {
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showErrors(cerr);
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cerr << "program terminating." << endl;
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return -1;
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}
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}
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#ifndef CXX_DEMO
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int main()
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{
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return flamespeed(0, 0);
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}
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#endif
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