From 31fe8476998fe3ae91d3c31cb5357c9a714111af Mon Sep 17 00:00:00 2001 From: Gabriele Seitz <gabriele.seitz@iws.uni-stuttgart.de> Date: Wed, 18 Oct 2017 14:21:34 +0200 Subject: [PATCH] [1pncmin] add test and reference --- .../1pnc/implicit/test_box1pnc.input | 2 +- .../1pncmin/implicit/CMakeLists.txt | 69 ++--- .../1pncmin/implicit/thermochemproblem.hh | 107 ++++--- .../implicit/thermochemspatialparams.hh | 33 +-- test/references/box1pncmin-00042.vtu | 273 ++++++++++++++++++ test/references/cc1pncmin-00042.vtu | 219 ++++++++++++++ 6 files changed, 573 insertions(+), 130 deletions(-) create mode 100644 test/references/box1pncmin-00042.vtu create mode 100644 test/references/cc1pncmin-00042.vtu diff --git a/test/porousmediumflow/1pnc/implicit/test_box1pnc.input b/test/porousmediumflow/1pnc/implicit/test_box1pnc.input index 85a6863ffc..56c07d2043 100644 --- a/test/porousmediumflow/1pnc/implicit/test_box1pnc.input +++ b/test/porousmediumflow/1pnc/implicit/test_box1pnc.input @@ -8,7 +8,7 @@ UpperRight = 1 1 Cells = 20 2 [Problem] -Name = outflowbox # name passed to the output routines +Name = 1pnctestbox # name passed to the output routines EnableGravity = 0 # disable gravity [Vtk] diff --git a/test/porousmediumflow/1pncmin/implicit/CMakeLists.txt b/test/porousmediumflow/1pncmin/implicit/CMakeLists.txt index 91d858c04b..813b2ec775 100644 --- a/test/porousmediumflow/1pncmin/implicit/CMakeLists.txt +++ b/test/porousmediumflow/1pncmin/implicit/CMakeLists.txt @@ -2,50 +2,29 @@ add_input_file_links() -add_executable(test_box1pncmin test_box1pncmin.cc) -add_executable(test_cc1pncmin test_cc1pncmin.cc) - -# add_executable_all(test_box1p2c test_box1p2c.cc) -# -# add_executable_all(test_cc1p2c test_cc1p2c.cc) - -# dune_symlink_to_source_files(FILES test_2pnc.input) -# # dune_symlink_to_source_files(FILES test_box2pnc.input) -# dune_symlink_to_source_files(FILES test_box1p2c.input) -# dune_symlink_to_source_files(FILES test_cc1p2c.input) - -# set(BUILD_TYPE Debug) - -#install sources -# install(FILES -# thermochemproblem.hh -# thermochemspatialparams.hh -# test_box2pnc.cc -# test_cc2pnc.cc -# DESTINATION ${CMAKE_INSTALL_INCLUDEDIR}/dumux-devel/appl/thermochemistry) - - -# # isothermal tests -# add_dumux_test(test_box2pnc test_box2pnc test_box2pnc.cc -# python ${dumux_INCLUDE_DIRS}/bin/testing/runtest.py -# --script fuzzy -# --files ${CMAKE_SOURCE_DIR}/test/references/fuelcell2pncbox-reference.vtu -# ${CMAKE_CURRENT_BINARY_DIR}/fuelcell-box-00016.vtu -# --command "${CMAKE_CURRENT_BINARY_DIR}/test_box2pnc -ParameterFile test_2pnc.input -Problem.Name fuelcell-box") -# -# add_dumux_test(test_cc2pnc test_cc2pnc test_cc2pnc.cc -# python ${dumux_INCLUDE_DIRS}/bin/testing/runtest.py -# --script fuzzy -# --files ${CMAKE_SOURCE_DIR}/test/references/fuelcell2pnccc-reference.vtu -# ${CMAKE_CURRENT_BINARY_DIR}/fuelcell-cc-00016.vtu -# --command "${CMAKE_CURRENT_BINARY_DIR}/test_cc2pnc -ParameterFile test_2pnc.input -Problem.Name fuelcell-cc") -# -# dune_symlink_to_source_files(FILES test_2pnc.input) +# add_executable(test_box1pncmin test_box1pncmin.cc) +# add_executable(test_cc1pncmin test_cc1pncmin.cc) + +add_dumux_test(test_box1pncmin test_box1pncmin test_box1pncmin.cc + python ${CMAKE_SOURCE_DIR}/bin/testing/runtest.py + --script fuzzy + --files ${CMAKE_SOURCE_DIR}/test/references/box1pncmin-00042.vtu + ${CMAKE_CURRENT_BINARY_DIR}/box1pncmin-00042.vtu + --command "${CMAKE_CURRENT_BINARY_DIR}/test_box1pncmin" + --zeroThreshold {"temperature":5e-6}) + +add_dumux_test(test_cc1pncmin test_cc1pncmin test_cc1pncmin.cc + python ${CMAKE_SOURCE_DIR}/bin/testing/runtest.py + --script fuzzy + --files ${CMAKE_SOURCE_DIR}/test/references/cc1pncmin-00042.vtu + ${CMAKE_CURRENT_BINARY_DIR}/cc1pncmin-00042.vtu + --command "${CMAKE_CURRENT_BINARY_DIR}/test_cc1pncmin" + --zeroThreshold {"temperature":5e-6}) # # #install sources -# install(FILES -# thermochemproblem.hh -# thermochemspatialparams.hh -# test_box2pnc.cc -# test_cc2pnc.cc -# DESTINATION ${CMAKE_INSTALL_INCLUDEDIR}/dumux/test/implicit/2pnc) +install(FILES +thermochempatialparams.hh +thermochemproblem.hh +test_box1pncmin.cc +test_cc1pncmin.cc +DESTINATION ${CMAKE_INSTALL_INCLUDEDIR}/dumux/test/implicit/1pncmin) diff --git a/test/porousmediumflow/1pncmin/implicit/thermochemproblem.hh b/test/porousmediumflow/1pncmin/implicit/thermochemproblem.hh index 21847e375f..cdea15dd73 100644 --- a/test/porousmediumflow/1pncmin/implicit/thermochemproblem.hh +++ b/test/porousmediumflow/1pncmin/implicit/thermochemproblem.hh @@ -71,8 +71,7 @@ SET_PROP(ThermoChemProblem, FluidSystem) // Enable velocity output SET_BOOL_PROP(ThermoChemProblem, VtkAddVelocity, false); -SET_TYPE_PROP(ThermoChemProblem, LinearSolver, UMFPackBackend<TypeTag>); - +// SET_TYPE_PROP(ThermoChemProblem, LinearSolver, UMFPackBackend<TypeTag>); // Set the spatial parameters SET_TYPE_PROP(ThermoChemProblem, SpatialParams, ThermoChemSpatialParams<TypeTag>); @@ -211,7 +210,7 @@ public: if(globalPos[0] < eps_ ) { -// values.setDirichlet(pressureIdx); + values.setDirichlet(pressureIdx); values.setDirichlet(firstMoleFracIdx); values.setDirichlet(temperatureIdx); } @@ -234,43 +233,44 @@ public: */ PrimaryVariables dirichletAtPos(const GlobalPosition &globalPos) const { - PrimaryVariables priVars(0.0); + PrimaryVariables priVars(0.0); - //input parameters -// Scalar pIn; - Scalar pOut; - Scalar tIn; - Scalar tOut; - Scalar vaporIn; + //input parameters + Scalar pIn; + Scalar pOut; + Scalar tIn; + Scalar tOut; + Scalar vaporIn; // read input parameters - if (isCharge_ == true){ -// pIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureIn); - pOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureOut); - tIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureIn); - tOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureOut); - vaporIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, VaporIn); - - } + if (isCharge_ == true){ + pIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureIn); + pOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureOut); + tIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureIn); + tOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureOut); + vaporIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, VaporIn); + } + else{ -// pIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureIn); - pOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureOut); - tIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureIn); - tOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureOut); - vaporIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, VaporIn); - } + pIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureIn); + pOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureOut); + tIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureIn); + tOut = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureOut); + vaporIn = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, VaporIn); + } if(globalPos[0] < eps_) { + priVars[pressureIdx] = pIn; priVars[firstMoleFracIdx] = vaporIn; // Saturation outer boundary priVars[temperatureIdx] = tIn; } + if(globalPos[0] > this->bBoxMax()[0] - eps_) { priVars[pressureIdx] = pOut; priVars[firstMoleFracIdx] = 0.01; // Saturation inner boundary priVars[temperatureIdx] = tOut; - } return priVars; @@ -299,16 +299,16 @@ public: { PrimaryVariables priVars(0.0); - if(globalPos[0] < eps_) - { +// if(globalPos[0] < eps_) +// { +// +// if (isCharge_ == true){ +// priVars[pressureIdx] = -GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, InFlow); //[mol/s] gas inflow; negative sign: inflow +// } +// else +// priVars[pressureIdx] = -GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, InFlow); //[mol/s] gas inflow +// } - if (isCharge_ == true){ - priVars[pressureIdx] = -GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, InFlow); //[mol/s] gas inflow; negative sign: inflow - } - else - priVars[pressureIdx] = -GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, InFlow); //[mol/s] gas inflow - } -// std::cout << " test neumann " << "\n"; return priVars; } @@ -334,22 +334,21 @@ public: Scalar CaO2H2Init; if (isCharge_ == true){ - pInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureInitial); - tInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureInitial); - h2oInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, VaporInitial); - CaOInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, CaOInitial); - CaO2H2Init = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, CaO2H2Initial); + pInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, PressureInitial); + tInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, TemperatureInitial); + h2oInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, VaporInitial); + CaOInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, CaOInitial); + CaO2H2Init = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Charge, CaO2H2Initial); } else { - std::cout << "false " << "\n"; - pInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureInitial); - tInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureInitial); - h2oInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, VaporInitial); - CaOInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, CaOInitial); - CaO2H2Init = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, CaO2H2Initial); + pInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, PressureInitial); + tInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, TemperatureInitial); + h2oInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, VaporInitial); + CaOInit = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, CaOInitial); + CaO2H2Init = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, Scalar, Discharge, CaO2H2Initial); } - std::cout << "CaO2H2Init = " << CaO2H2Init << "\n"; + priVars[pressureIdx] = pInit; priVars[firstMoleFracIdx] = h2oInit; #if NONISOTHERMAL @@ -385,10 +384,10 @@ public: if(volVars.moleFraction(phaseIdx, firstMoleFracIdx) > 1e-3) moleFractionVapor = volVars.moleFraction(phaseIdx, firstMoleFracIdx) ; - if(volVars.moleFraction(phaseIdx, firstMoleFracIdx) >= 1.0){ - moleFractionVapor = 1; -// std::cout << " test vapor = " << "\n"; - } + + if(volVars.moleFraction(phaseIdx, firstMoleFracIdx) >= 1.0) moleFractionVapor = 1; + + Scalar vaporPressure = volVars.pressure(phaseIdx) *moleFractionVapor ; vaporPressure *= 1.0e-5; Scalar pFactor = log(vaporPressure); @@ -423,9 +422,9 @@ public: // make sure not more CaO reacts than present - if (- q*this->timeManager().timeStepSize() + moleFracCaO_sPhase* volVars.molarDensity(cPhaseIdx) < 0 + eps_){ + if (- q*this->timeManager().timeStepSize() + moleFracCaO_sPhase* volVars.molarDensity(cPhaseIdx) < 0 + eps_) + { q = moleFracCaO_sPhase/this->timeManager().timeStepSize(); -// std::cout << "q_discharge = " << q << "\n"; } source[conti0EqIdx+CaO2H2Idx] = q; @@ -449,9 +448,9 @@ public: Scalar q = -rDehydration; - if (- q*this->timeManager().timeStepSize() + moleFracCaO2H2_sPhase*volVars.molarDensity(hPhaseIdx) < 0){ + if (- q*this->timeManager().timeStepSize() + moleFracCaO2H2_sPhase*volVars.molarDensity(hPhaseIdx) < 0) + { q = moleFracCaO2H2_sPhase/this->timeManager().timeStepSize(); - } source[conti0EqIdx+CaO2H2Idx] = -q; diff --git a/test/porousmediumflow/1pncmin/implicit/thermochemspatialparams.hh b/test/porousmediumflow/1pncmin/implicit/thermochemspatialparams.hh index 36ee0d5715..80cc28c118 100644 --- a/test/porousmediumflow/1pncmin/implicit/thermochemspatialparams.hh +++ b/test/porousmediumflow/1pncmin/implicit/thermochemspatialparams.hh @@ -70,13 +70,10 @@ class ThermoChemSpatialParams : public ImplicitSpatialParamsOneP<TypeTag> enum { dim=GridView::dimension, dimWorld=GridView::dimensionworld, - -// wPhaseIdx = FluidSystem::wPhaseIdx }; using GlobalPosition = Dune::FieldVector<CoordScalar, dimWorld>; using Tensor = Dune::FieldMatrix<CoordScalar, dimWorld, dimWorld>; -// using FVElementGeometry = typename GET_PROP_TYPE(TypeTag, FVElementGeometry); using SubControlVolume = typename GET_PROP_TYPE(TypeTag, SubControlVolume); using Element = typename GridView::template Codim<0>::Entity; @@ -94,12 +91,6 @@ public: ThermoChemSpatialParams(const Problem& problem, const GridView &gridView) : ParentType(problem, gridView) { - // intrinsic permeabilities -// K_[0][0] = 5e-12; -// K_[1][1] = 5e-12; -// K_[0][0] = 2.23e-14; -// K_[1][1] = 2.23e-14; - //thermal conductivity of CaO lambdaSolid_ = 0.4; //[W/(m*K)] Nagel et al [2013b] @@ -119,19 +110,6 @@ public: permLaw_.init(*this); } - /*! Old - * \brief Apply the intrinsic permeability tensor to a pressure - * potential gradient. - * - * \param element The current finite element - * \param fvGeometry The current finite volume geometry of the element - * \param scvIdx The index of the sub-control volume - */ -// const DimMatrix intrinsicPermeability(const Element &element, -// const FVElementGeometry &fvGeometry, -// const int scvIdx) const -// { return K_; } -// /*! * \brief Define the initial permeability \f$[m^2]\f$ distribution * @@ -237,9 +215,6 @@ public: const ElementSolutionVector& elemSol) const { return 790; -// 42 // specific heat capacity of CaO [J / (kg K)] -// * 3370 // density of CaO [kg/m^3] -// * (1 - porosity(element, fvGeometry, scvIdx)); // for CaO only!! } /*! @@ -272,11 +247,9 @@ public: { return lambdaSolid_; } private: -// DimMatrix K_; -// Scalar porosity_; - Scalar eps_; -// MaterialLawParams materialParams_; - Scalar lambdaSolid_; + + Scalar eps_; + Scalar lambdaSolid_; bool isCharge_ = GET_RUNTIME_PARAM_FROM_GROUP(TypeTag, bool, Problem, IsCharge); PorosityLaw poroLaw_; PermeabilityLaw permLaw_; diff --git a/test/references/box1pncmin-00042.vtu b/test/references/box1pncmin-00042.vtu new file mode 100644 index 0000000000..972d3f0946 --- /dev/null +++ b/test/references/box1pncmin-00042.vtu @@ -0,0 +1,273 @@ +<?xml version="1.0"?> +<VTKFile type="UnstructuredGrid" version="0.1" byte_order="LittleEndian"> + <UnstructuredGrid> + <Piece NumberOfCells="80" NumberOfPoints="123"> + <PointData Scalars="temperature"> + <DataArray type="Float32" Name="temperature" NumberOfComponents="1" format="ascii"> + 773.15 748.138 773.15 748.138 732.976 732.976 731.372 731.372 731.432 731.432 731.682 731.682 + 731.957 731.957 732.236 732.236 732.518 732.518 732.8 732.8 733.082 733.082 733.363 733.363 + 733.639 733.639 733.908 733.908 734.167 734.167 734.411 734.411 734.632 734.632 734.823 734.823 + 734.971 734.971 735.062 735.062 735.074 735.074 734.972 734.972 734.673 734.673 734.151 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