44 lines
1.1 KiB
C++
44 lines
1.1 KiB
C++
/*
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* Sample program that solves an implicit problem for surface
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* site fractions.
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*/
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#include <iostream>
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#include "cantera/IdealGasMix.h"
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#include "cantera/Interface.h"
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using namespace Cantera;
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using namespace std;
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int main()
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{
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try {
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IdealGasMix gas("gri30.xml", "gri30");
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gas.setState_TPX(1200.0, OneAtm,
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"H2:2, O2:1, OH:0.01, H:0.01, O:0.01");
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vector<ThermoPhase*> phases;
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phases.push_back(&gas);
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Interface surf("surface.xml", "surface", phases);
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vector_fp cov;
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cov.push_back(0.8);
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cov.push_back(0.2);
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surf.setCoverages(DATA_PTR(cov));
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vector_fp wdot(gas.nSpecies() + surf.nSpecies());
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surf.getNetProductionRates(DATA_PTR(wdot));
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int k;
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for (k = 0; k < gas.nSpecies(); k++) {
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cout << gas.speciesName(k) << " " << wdot[k] << endl;
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}
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for (k = 0; k < surf.nSpecies(); k++)
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cout << surf.speciesName(k) << " "
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<< wdot[k+gas.nSpecies()] << endl;
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} catch (CanteraError) {
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showErrors(cout);
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}
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return 0;
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}
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