| ▼ applications | |
| ▼ PUfoam | |
| ▼ foamAging | |
| plotFoamAging.py | |
| prep_init_foamConductivity.py | |
| ▼ foamExpansion | |
| ► case | |
| workflow.py | |
| ► examples | |
| ► BaserKinetics | |
| ► inputs | |
| processResults.py | |
| workflow.py | |
| ► RF1Kinetics | |
| ► inputs | |
| processResults.py | |
| workflow.py | |
| ► inputs | |
| workflow.py | |
| plotWallDrainage.py | |
| prep_init_foamConductivity.py | |
| ▼ foamingProcess3D | |
| createInputs.py | Creates input files for Bubble growth and QmomKinetics detailed models |
| ▼ MoDeNaModels | |
| ► bubbleGrowth | |
| ► src | |
| ► src | |
| constants.f90 | Stores physical constants and floating point precision |
| dgtsl.f90 | Solver for tridiagonal SLAE |
| fake_modena.c | MoDeNa bindings used when MoDeNa library is not installed |
| foaming_globals.f90 | Stores global variables for Foaming application |
| globals.f90 | Stores global variables |
| hbrd.f90 | Hybrid Powell method for SNAE |
| in_out.f90 | Subroutines controlling input and output |
| integration.f90 | Controls the integration |
| interpolation.f90 | Piecewise linear interpolation |
| ioutils.f90 | Tools for file input/output |
| main.f90 | Main executable program |
| model.f90 | Physical model of bubble growth |
| model_sundials.f90 | Interface for sundials |
| modenastuff.f90 | Definitions of modena variables |
| opkda1.f | |
| opkda2.f | |
| opkdmain.f | |
| phys_prop.f90 | Calculates material properties of the system |
| tests.f90 | Top level subroutines |
| __init__.py | |
| bubbleGrowth.py | |
| ► CFD_tool_0D | |
| ► src | |
| ► eigen | |
| ► src | |
| dcopy.f | |
| dgemm.f | |
| dger.f | |
| dgesv.f | |
| dgetf2.f | |
| dgetrf.f | |
| dgetrs.f | |
| disnan.f | |
| dlae2.f | |
| dlaebz.f | |
| dlaev2.f | |
| dlaisnan.f | |
| dlamch.f | |
| dlaneg.f | |
| dlanst.f | |
| dlapy2.f | |
| dlar1v.f | |
| dlarnv.f | |
| dlarra.f | |
| dlarrb.f | |
| dlarrc.f | |
| dlarrd.f | |
| dlarre.f | |
| dlarrf.f | |
| dlarrj.f | |
| dlarrk.f | |
| dlarrr.f | |
| dlarrv.f | |
| dlartg.f | |
| dlaruv.f | |
| dlascl.f | |
| dlaset.f | |
| dlasq2.f | |
| dlasq3.f | |
| dlasq4.f | |
| dlasq5.f | |
| dlasq6.f | |
| dlasr.f | |
| dlasrt.f | |
| dlassq.f | |
| dlaswp.f | |
| dscal.f | |
| dstegr.f | |
| dstemr.f | |
| dsteqr.f | |
| dswap.f | |
| dtrsm.f | |
| idamax.f | |
| ieeeck.f | |
| ilaenv.f | |
| iparmq.f | |
| lsame.f | |
| vandermonde.f | |
| xerbla.f | |
| bubbleRadius.h | Functions related to the calculations of bubble radius |
| coalescence.h | Source term due to the bubble coalescence |
| determinant.h | Calcualte the determinant of an n by n matrix |
| differenceTable.h | Calculate difference table for the moments realizability check |
| experimentalInputs.h | All the experimental data required for the source terms calculations |
| growth.h | Source terms due to the bubble growth |
| HankelHadamard.h | Checks for moments realizability |
| initializeMoments.h | Initializes the moments |
| liquidBA.h | Maximum soluble physical blowing agent in the liquid mixture |
| McGrawCorrection.h | McGraw correction algorithm |
| modenaCalls.h | Instantiate the surrogate models: |
| modenaData.h | Allocate memory for the surrogate models |
| momentsConverter.h | Converts moments based on the unit volume of foam |
| partialPressure.h | Functions related to the calculations of partial pressures |
| pda.h | Product Difference Algorithm |
| QmomKinetics.cpp | Macro-scale tool for the foaming process |
| readParameters.h | Reads the inputs from input files |
| WrightCorrection.h | Wright corrections for moments realizability |
| write_kinetics.h | Write the results into text files |
| __init__.py | |
| QmomKinetics.py | |
| ► CFD_tool_3D | |
| ► applications | |
| ► postProcessBSD | |
| ► twoPhaseMixtureThermo | |
| ► lnInclude | |
| twoPhaseMixtureThermo.C | |
| twoPhaseMixtureThermo.H | |
| twoPhaseMixtureThermo.C | |
| twoPhaseMixtureThermo.H | |
| postProcessBSD.C | Post-processing application to calculate the mean and variance of bubble size distribution |
| ► src | |
| ► eigen | |
| ► src | |
| dcopy.f | |
| dgemm.f | |
| dger.f | |
| dgesv.f | |
| dgetf2.f | |
| dgetrf.f | |
| dgetrs.f | |
| disnan.f | |
| dlae2.f | |
| dlaebz.f | |
| dlaev2.f | |
| dlaisnan.f | |
| dlamch.f | |
| dlaneg.f | |
| dlanst.f | |
| dlapy2.f | |
| dlar1v.f | |
| dlarnv.f | |
| dlarra.f | |
| dlarrb.f | |
| dlarrc.f | |
| dlarrd.f | |
| dlarre.f | |
| dlarrf.f | |
| dlarrj.f | |
| dlarrk.f | |
| dlarrr.f | |
| dlarrv.f | |
| dlartg.f | |
| dlaruv.f | |
| dlascl.f | |
| dlaset.f | |
| dlasq2.f | |
| dlasq3.f | |
| dlasq4.f | |
| dlasq5.f | |
| dlasq6.f | |
| dlasr.f | |
| dlasrt.f | |
| dlassq.f | |
| dlaswp.f | |
| dscal.f | |
| dstegr.f | |
| dstemr.f | |
| dsteqr.f | |
| dswap.f | |
| dtrsm.f | |
| idamax.f | |
| ieeeck.f | |
| ilaenv.f | |
| iparmq.f | |
| lsame.f | |
| vandermonde.f | |
| xerbla.f | |
| ► initMoments | |
| ► CMakeFiles | |
| ► 3.5.1 | |
| ► CompilerIdC | |
| CMakeCCompilerId.c | |
| ► CompilerIdCXX | |
| CMakeCXXCompilerId.cpp | |
| feature_tests.c | |
| initMoments.C | |
| PDA.H | |
| ► twoPhaseMixtureThermo | |
| ► lnInclude | |
| twoPhaseMixtureThermo.C | |
| twoPhaseMixtureThermo.H | |
| twoPhaseMixtureThermo.C | |
| twoPhaseMixtureThermo.H | |
| alphaCorrection.H | Checks the boundedness of alpha (phase volume fraction) |
| alphaEqns.H | Builds and solves the phase volume fraction equation |
| alphaEqnsSubCycle.H | |
| BACheck.H | Checks the boundedness of field variables related to the physical and chemical blowing agents |
| BAEqns.H | Builds the PDEs for the presence of different blowing agents. It also considers the user choice for the solution of PBE |
| BASources.H | Builds the RHS of PDEs for the blowing agents |
| checkGellingPoint.H | Checks if the gelling point reaches |
| coalescenceKernel.H | Constant coalescence kernel |
| coalescenceSource.H | Source term due to bubbles coalescence |
| continuityErrors.H | Calculates and reports the continuity error |
| conversionCheck.H | Checks the boundedness of coversion values (for polyol and water) |
| conversionEqns.H | Builds and solves conversion equations based on the kinetic model chosen |
| conversionSources.H | Builds the RHS of conversion equations based on the kinetics model chosen |
| createFields.H | Creates all the required field variables |
| densityEqns.H | Calculates the PU foam density |
| growthRate.H | Three different functions for growth rate |
| growthSource.H | Source term due to bubble growth |
| KineticsFields.H | Creates the field variables related to the PU kinetics |
| KineticsFunctions.H | Functions for kinetics calculations |
| modenaCalls.H | Instantiates the surrogate models |
| modenaData.H | Allocate memory for the surrogate models |
| MomConvert.H | Converts moments based on the unit volume of foam |
| MomEqns.H | Builds and solves moments equations |
| MomFields.H | Creates the field variables related to the moments |
| MomSources.H | Builds the RHS of PDEs for the moments |
| PDA.H | |
| pEqn.H | Builds and solves pressure equation |
| PUFoam.C | Macro-scale CFD tool for 3D simulation of foam expansion |
| readControls.H | Read controls |
| rheologyFields.H | Creates the field variables for the rheology |
| rheologyModel.H | Implementatino of three rheology models including constant, Newtonian, and non-Newtonian |
| simulationMode.H | Defines mold-filling and validation as two simulation modes |
| TCheck.H | Checks the boundedness of temperature values |
| thermalFields.H | Creates the field variables for the temperature equation |
| TSEqn.H | Builds and solves the temperature equation |
| TSSource.H | Builds the RHS of temperature equation |
| UEqn.H | Momentum equation |
| __init__.py | |
| CFD_tool_3D.py | |
| ► diffusivity | |
| __init__.py | |
| diffusivity.py | |
| ► foamAging | |
| ► src | |
| ► src | |
| conductivity.f90 | Calculation of thermal conductivity |
| constants.f90 | Physical constants and other parameters |
| globals.f90 | Global variables |
| InOut.f90 | File input and output |
| integration.f90 | Controls the integration |
| ioutils.f90 | Tools for file input/output |
| main.f90 | Main executable program |
| model.f90 | Model subroutines |
| odepack.f | |
| odepack_sub1.f | |
| odepack_sub2.f | |
| physicalProperties.f90 | Calculates material properties of the system |
| __init__.py | |
| foamAging.py | |
| ► foamConductivity | |
| ► src | |
| ► src | |
| besselj.f90 | |
| bessely.f90 | |
| complex.f90 | |
| condrad.f90 | Conductive-radiative heat transfer simulation |
| conduction.f90 | Conductive heat transfer simulations |
| constants.f90 | Physical constants and global variables |
| cylprop.f90 | Estimation of effect of struts on radiative properties |
| dagmg.f90 | |
| filmprop.f90 | Estimation of effect of walls on radiative properties |
| foamgeom.f90 | Morphology descriptors |
| foamprop.f90 | Effective properties of the foam |
| gasprop.f90 | Gas properties |
| hbrd.f90 | Hybrid Powell method for SNAE |
| interpolation.f90 | Piecewise linear interpolation |
| ioutils.f90 | Tools for file input/output |
| main.f90 | Main executable program |
| physicalProperties.f90 | Properties of gas and solid phase |
| quadpack.f90 | |
| solidprop.f90 | Effective properties of solid |
| specfun.f90 | Special mathematical functions |
| tests.f90 | Top level routines |
| utilit.f90 | |
| __init__.py | |
| foamConductivity.py | |
| ► FoamConstruction | |
| ► foamreconstr | |
| ► src | |
| allocation.cc | Shorthand functions for allocation of matrices |
| allocation.hh | |
| determinant.cc | Functions for calculating determinant |
| determinant.hh | |
| edges.cc | Functions for creating struts at cell edges |
| edges.hh | |
| foams.cc | Main reconstruction algorithm |
| geometry.cc | Helpful geometric and mathematical functions |
| geometry.hh | |
| globals.cc | Global variables |
| globals.hh | Defines global variables, macros, templates and namespace |
| inout.cc | Functions for input and output operations |
| inout.hh | |
| nodes.cc | Functions for creating struts at cell vertices |
| nodes.hh | |
| seeds.cc | Functions for the initialization of seeds |
| seeds.hh | |
| skeleton.cc | Functions for geometric tessellation. Vertices and edges are used |
| skeleton.hh | |
| struts.cc | Functions governing creation of struts |
| struts.hh | |
| walls.cc | Functions for creation of walls from Voronoi tessellation |
| walls.hh | |
| __init__.py | |
| FoamGeometryConstruction_Periodic.py | |
| periodicBox.py | |
| run.py | |
| vtkconv.py | |
| ► FoamElasticModulus | |
| ► src | |
| spdeclarations.h | |
| spdistrib.c | |
| spherepack.c | |
| __init__.py | |
| AbaqusSimulation.py | |
| ElasticModulus.py | |
| ► gasConductivity | |
| __init__.py | |
| gasConductivity.py | |
| ► gasMixtureConductivity | |
| __init__.py | |
| gasMixtureConductivity.py | |
| ► Kinetics | |
| __init__.py | |
| Kinetics.py | |
| predici_2_modena.py | |
| PrediciKinetics.py | |
| RF-1-public.c | |
| ► polymerConductivity | |
| __init__.py | |
| polymerConductivity.py | |
| ► PolymerDensity | |
| ► ExampleOfUsage | |
| ► src | |
| MacroscopicProblem.C | |
| Density.py | |
| ► src | |
| ► DetailedModelCode | |
| getting_started_subroutines.f90 | |
| main.f90 | |
| module_solve_nonlinear.f90 | |
| modules.f90 | |
| Numeric_subroutines.f90 | |
| VLE_main.f90 | |
| VLE_subroutines.f90 | |
| __init__.py | |
| PolymerDensity.py | |
| ► PolymerDensity_units | |
| __init__.py | |
| density_reaction_mixture.py | Surrogate function and model definitions for the density of the reaction mixturemode |
| ► polymerViscosity | |
| __init__.py | |
| polymerViscosity.py | |
| ► Rheology | |
| ► Example_WorkflowIntegration | |
| ► src_dummy | |
| workflowdummy.f90 | |
| WorkflowTest.py | |
| ► src | |
| rheologyexactdummy.f90 | |
| __init__.py | |
| Rheology.py | |
| ► Rheology_Arrhenius | |
| __init__.py | |
| Rheology_Arrhenius.py | |
| ► Solubility | |
| ► ExampleOfUsage | |
| ► src | |
| MacroscopicProblem.C | |
| SolubilityMacroscopicTask.py | |
| ► src | |
| BubblePoint.f90 | This Subroutine performs a bubble point calculation |
| cg_descent.f90 | |
| crit_point_mixtures.f90 | |
| DFT-MF.f90 | |
| DFT-nMF-mixtures.f90 | |
| DFT-nMF-units.f90 | |
| DFT-nMF2.f90 | |
| DFT-utilities.f90 | |
| eos.f90 | |
| eos_const.f90 | |
| eos_critical_renorm.f90 | |
| eos_critical_renorm_mix.f90 | |
| eos_enthalpy.f90 | |
| eos_f_contributions.f90 | |
| eos_numerical.f90 | |
| eos_polar.f90 | |
| eos_polar_second_deriv.f90 | |
| gc_method.f90 | |
| input_output.f90 | |
| kij-fitting.f90 | |
| levenberg_marquardt.f90 | |
| main_prog.f90 | Main program |
| matrix_inversion-aux.f90 | |
| matrix_inversion.f90 | |
| matrix_inversion2.f90 | |
| mod_basic_variables.f90 | |
| para_input.f90 | |
| phase_equilib.f90 | |
| powell_minimize.f90 | |
| pt1.f90 | |
| pure_par_fit.f90 | |
| rdf_hs.f90 | |
| starting_value.f90 | This subroutine performs a phase equilibrium calculation |
| utilities.f90 | |
| __init__.py | |
| Solubility.py | |
| ► StrutContent | |
| __init__.py | |
| StrutContent.py | |
| ► SurfaceTension | |
| ► ExampleOfUsage | |
| ► src | |
| MacroscopicProblem.C | |
| SurfaceTensionExactTask.py | |
| ► src | |
| AD_Routines.F90 | |
| crit_point_mixtures.F90 | |
| Function.F90 | This file contains the residual function of the density functional theory calculation |
| getting_started_subroutines.F90 | |
| Helfer_Routinen.F90 | |
| InitialGuess.F90 | |
| Main.F90 | |
| mod_ChemPot.F90 | |
| mod_DFT_CHAIN.F90 | This file contains the subroutines which calculate the contribution of chain formation to the Helmholtz energy functional |
| mod_DFT_CHAIN_d.F90 | This file contains the subroutines which calculate the derivatives of the contribution of chain formation to the Helmholtz energy functional. These derivatives were obtained from the TAPENADE automatic differentiation online tool |
| mod_DFT_DISP_WDA.F90 | |
| mod_DFT_DISP_WDA_d.F90 | This file contains the subroutines which calculate the derivatives of th contribution of dispersion to the Helmholtz energy functional. These derivatives were generated by the TAPEANDE online automatic differentiation tool |
| mod_DFT_FMT.F90 | This file contains the subroutines which calculate the contribution of volume exclusion to the Helmholtz energy functional |
| mod_DFT_FMT_d.F90 | This file contains the subroutines which calculate the derivatives of the contribution of volume exclusion to the Helmholtz energy functional. These derivatives were obtained by automatic differentiation using the TAPENADE online tool |
| mod_PETSc.F90 | |
| module_solve_nonlinear.F90 | |
| Modules.F90 | |
| Numeric_subroutines.F90 | |
| SolverSetup.F90 | |
| Spline_Integration_d.F90 | |
| VLE_main.F90 | This file contains the subroutine which controls the phase equilibrium calculation |
| __init__.py | |
| SurfaceTension.py | |
| ► wallDrainage | |
| ► src | |
| constants.f90 | Physical constants |
| globals.f90 | Global variables |
| hbrd.f90 | Hybrid Powell method for SNAE |
| in_out.f90 | File input and output |
| integration.f90 | Sets up and integrates the models |
| ioutils.f90 | Tools for file input/output |
| main.f90 | Main executable program |
| model.f90 | Physical model for wall formation |
| opkda1.f | |
| opkda2.f | |
| opkdmain.f | |
| phys_prop.f90 | Physical properties |
| __init__.py | |
| plot.py | |
| wallDrainage.py | |
| ▼ examples | |
| ▼ MoDeNaModels | |
| ▼ flowRate | |
| ► src | |
| flowRateExact.C | |
| __init__.py | |
| flowRate.py | |
| ▼ flowRate_idealGas | |
| ► src | |
| flowRateExact.C | |
| __init__.py | |
| flowRate_idealGas.py | |
| ▼ fullerEtAlDiffusion | |
| __init__.py | |
| fullerEtAlDiffusion.py | |
| ▼ idealGas | |
| __init__.py | |
| idealGas.py | |
| ▼ twoTank | |
| ► src | |
| twoTanksMacroscopicProblem.C | |
| __init__.py | |
| twoTank.py | |
| ▼ twoTankChained | |
| ► src | |
| twoTanksMacroscopicProblem.C | |
| __init__.py | |
| twoTankChained.py | |
| ▼ twoTankCxx | |
| ► src | |
| twoTanksMacroscopicProblemCxx.C | |
| __init__.py | |
| twoTankCxx.py | |
| ▼ twoTankFortran | |
| ► src | |
| twoTanksMacroscopicProblemFortran.f90 | |
| __init__.py | |
| twoTankFortran.py | |
| ▼ multicomponentDiffusion | |
| ▼ src | |
| fullerEtAlDiffusionTest.C | |
| ▼ src | |
| ▼ python | |
| __init__.py | Module providing the MoDeNa python interface |
| setup.py | |
| Strategy.py | Module providing strategies |
| SurrogateModel.py | Module providing functions and models |
| ▼ src | |
| fmodena.f90 | |
| function.c | |
| function.h | |
| global.c | |
| global.h | |
| indexset.c | |
| indexset.h | |
| inline.h | |
| inputsoutputs.c | |
| inputsoutputs.h | |
| model.c | |
| model.h | |
| modena.h | |
| modenaModel.H | |
| twoTanksFullProblem.C | |
1.8.13 
