restructured algorithm: moved into loop to reallocate fields and replan FFTW in case resolution changes during runtime ==> regridding
introduced parameters for selective debugging of spectral code and partly introduced the advanced divergence calculation again which is controlled by debug.config added switch in numerics to control divergence behavior (uncorrected and corrected by phenomenological factor) added precision directive to all values I found
This commit is contained in:
Martin Diehl
parent
f5ad143cf4
commit
5ef73e164a
File diff suppressed because it is too large
Load Diff
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@ -1416,6 +1416,8 @@ endfunction
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select case (warning_ID)
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case (33_pInt)
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msg = 'cannot guess along trajectory for first step of first loadcase'
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case (47_pInt)
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msg = 'No valid parameter for FFTW given, using FFTW_PATIENT'
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case (101_pInt)
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msg = '+ crystallite debugging off... +'
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case (600_pInt)
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@ -15,3 +15,7 @@ selective 1 # >0 true to switch on e,i,g selective deb
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element 1 # selected element for debugging (synonymous: "el", "e")
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ip 1 # selected integration point for debugging (synonymous: "integrationpoint", "i")
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grain 1 # selected grain at ip for debugging (synonymous: "gr", "g")
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### spectral solver debugging parameters ###
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generalDebugSpectral 0 # > 0: general (algorithmical) debug outputs
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divergenceDebugSpectral 0 # > 0: calculate more divergence measures and print them out
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@ -51,6 +51,7 @@ real(pReal) :: debug_jacobianMax
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real(pReal) :: debug_jacobianMin
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logical :: debug_selectiveDebugger = .true.
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integer(pInt) :: debug_verbosity = 1_pInt
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integer(pInt) :: spectral_debug_verbosity = 0_pInt
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CONTAINS
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@ -122,6 +123,12 @@ subroutine debug_init()
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debug_selectiveDebugger = IO_intValue(line,positions,2) > 0_pInt
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case ('verbosity')
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debug_verbosity = IO_intValue(line,positions,2)
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case ('generaldebugspectral') ! use bitwise logical and, continue with +8_pInt
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if(IO_intValue(line,positions,2)) spectral_debug_verbosity = spectral_debug_verbosity + 1_pInt
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case ('divergencedebugspectral')
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if(IO_intValue(line,positions,2)) spectral_debug_verbosity = spectral_debug_verbosity + 2_pInt
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case ('restartdebugspectral')
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if(IO_intValue(line,positions,2)) spectral_debug_verbosity = spectral_debug_verbosity + 4_pInt
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endselect
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enddo
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100 close(fileunit)
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@ -164,7 +171,11 @@ subroutine debug_init()
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debug_i = 0_pInt
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debug_g = 0_pInt
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endif
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!$OMP CRITICAL (write2out) ! bitwise coded
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if (iand(spectral_debug_verbosity,1_pInt)==1_pInt) write(6,'(a)') ' Spectral General Debugging'
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if (iand(spectral_debug_verbosity,2_pInt)==2_pInt) write(6,'(a)') ' Spectral Divergence Debugging'
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if (iand(spectral_debug_verbosity,4_pInt)==4_pInt) write(6,'(a)') ' Spectral Restart Debugging'
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!$OMP END CRITICAL (write2out)
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endsubroutine
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@ -196,6 +207,7 @@ subroutine debug_reset()
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debug_stressMin = huge(1.0_pReal)
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debug_jacobianMax = -huge(1.0_pReal)
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debug_jacobianMin = huge(1.0_pReal)
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spectral_debug_verbosity = 0.0_pReal
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endsubroutine
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@ -70,9 +70,10 @@ real(pReal) :: relevantStrain, & ! strain
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err_stress_tolrel, & ! factor to multiply with highest stress to get err_stress_tol
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fftw_timelimit, & ! sets the timelimit of plan creation for FFTW, see manual on www.fftw.org
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rotation_tol ! tolerance of rotation specified in loadcase
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character(len=64) fftw_planner_flag ! sets the planig-rigor flag, see manual on www.fftw.org
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logical memory_efficient ! for fast execution (pre calculation of gamma_hat)
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integer(pInt) itmax , & ! maximum number of iterations
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character(len=64) :: fftw_planner_flag ! sets the planig-rigor flag, see manual on www.fftw.org
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logical :: memory_efficient,& ! for fast execution (pre calculation of gamma_hat)
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divergence_correction ! correct divergence calculation in fourier space
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integer(pInt) :: itmax , & ! maximum number of iterations
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!* Random seeding parameters
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@ -172,8 +173,8 @@ subroutine numerics_init()
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fftw_timelimit = -1.0_pReal ! no timelimit of plan creation for FFTW
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fftw_planner_flag ='FFTW_PATIENT'
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rotation_tol = 1.0e-12
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!* Random seeding parameters: added <<<updated 27.08.2009>>>
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divergence_correction = .true.
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!* Random seeding parameters
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fixedSeed = 0_pInt
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@ -290,6 +291,8 @@ subroutine numerics_init()
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fftw_planner_flag = IO_stringValue(line,positions,2)
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case ('rotation_tol')
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rotation_tol = IO_floatValue(line,positions,2)
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case ('divergence_correction')
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divergence_correction = IO_intValue(line,positions,2) > 0_pInt
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!* Random seeding parameters
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case ('fixed_seed')
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@ -310,69 +313,64 @@ subroutine numerics_init()
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! writing parameters to output file
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!$OMP CRITICAL (write2out)
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write(6,'(a24,x,e8.1)') 'relevantStrain: ',relevantStrain
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write(6,'(a24,x,e8.1)') 'defgradTolerance: ',defgradTolerance
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write(6,'(a24,x,i8)') 'iJacoStiffness: ',iJacoStiffness
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write(6,'(a24,x,i8)') 'iJacoLpresiduum: ',iJacoLpresiduum
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write(6,'(a24,x,e8.1)') 'pert_Fg: ',pert_Fg
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write(6,'(a24,x,i8)') 'pert_method: ',pert_method
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write(6,'(a24,x,i8)') 'nCryst: ',nCryst
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write(6,'(a24,x,e8.1)') 'subStepMinCryst: ',subStepMinCryst
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write(6,'(a24,x,e8.1)') 'subStepSizeCryst: ',subStepSizeCryst
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write(6,'(a24,x,e8.1)') 'stepIncreaseCryst: ',stepIncreaseCryst
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write(6,'(a24,x,i8)') 'nState: ',nState
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write(6,'(a24,x,i8)') 'nStress: ',nStress
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write(6,'(a24,x,e8.1)') 'rTol_crystalliteState: ',rTol_crystalliteState
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write(6,'(a24,x,e8.1)') 'rTol_crystalliteTemp: ',rTol_crystalliteTemperature
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write(6,'(a24,x,e8.1)') 'rTol_crystalliteStress: ',rTol_crystalliteStress
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write(6,'(a24,x,e8.1)') 'aTol_crystalliteStress: ',aTol_crystalliteStress
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write(6,'(a24,2(x,i8))')'integrator: ',numerics_integrator
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write(6,*)
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write(6,'(a24,x,e8.1)') ' relevantStrain: ',relevantStrain
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write(6,'(a24,x,e8.1)') ' defgradTolerance: ',defgradTolerance
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write(6,'(a24,x,i8)') ' iJacoStiffness: ',iJacoStiffness
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write(6,'(a24,x,i8)') ' iJacoLpresiduum: ',iJacoLpresiduum
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write(6,'(a24,x,e8.1)') ' pert_Fg: ',pert_Fg
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write(6,'(a24,x,i8)') ' pert_method: ',pert_method
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write(6,'(a24,x,i8)') ' nCryst: ',nCryst
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write(6,'(a24,x,e8.1)') ' subStepMinCryst: ',subStepMinCryst
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write(6,'(a24,x,e8.1)') ' subStepSizeCryst: ',subStepSizeCryst
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write(6,'(a24,x,e8.1)') ' stepIncreaseCryst: ',stepIncreaseCryst
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write(6,'(a24,x,i8)') ' nState: ',nState
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write(6,'(a24,x,i8)') ' nStress: ',nStress
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write(6,'(a24,x,e8.1)') ' rTol_crystalliteState: ',rTol_crystalliteState
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write(6,'(a24,x,e8.1)') ' rTol_crystalliteTemp: ',rTol_crystalliteTemperature
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write(6,'(a24,x,e8.1)') ' rTol_crystalliteStress: ',rTol_crystalliteStress
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write(6,'(a24,x,e8.1)') ' aTol_crystalliteStress: ',aTol_crystalliteStress
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write(6,'(a24,2(x,i8),/)')' integrator: ',numerics_integrator
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write(6,'(a24,x,i8)') 'nHomog: ',nHomog
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write(6,'(a24,x,e8.1)') 'subStepMinHomog: ',subStepMinHomog
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write(6,'(a24,x,e8.1)') 'subStepSizeHomog: ',subStepSizeHomog
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write(6,'(a24,x,e8.1)') 'stepIncreaseHomog: ',stepIncreaseHomog
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write(6,'(a24,x,i8)') 'nMPstate: ',nMPstate
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write(6,*)
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write(6,'(a24,x,i8)') ' nHomog: ',nHomog
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write(6,'(a24,x,e8.1)') ' subStepMinHomog: ',subStepMinHomog
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write(6,'(a24,x,e8.1)') ' subStepSizeHomog: ',subStepSizeHomog
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write(6,'(a24,x,e8.1)') ' stepIncreaseHomog: ',stepIncreaseHomog
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write(6,'(a24,x,i8,/)') ' nMPstate: ',nMPstate
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!* RGC parameters
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write(6,'(a24,x,e8.1)') 'aTol_RGC: ',absTol_RGC
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write(6,'(a24,x,e8.1)') 'rTol_RGC: ',relTol_RGC
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write(6,'(a24,x,e8.1)') 'aMax_RGC: ',absMax_RGC
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write(6,'(a24,x,e8.1)') 'rMax_RGC: ',relMax_RGC
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write(6,'(a24,x,e8.1)') 'perturbPenalty_RGC: ',pPert_RGC
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write(6,'(a24,x,e8.1)') 'relevantMismatch_RGC: ',xSmoo_RGC
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write(6,'(a24,x,e8.1)') 'viscosityrate_RGC: ',viscPower_RGC
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write(6,'(a24,x,e8.1)') 'viscositymodulus_RGC: ',viscModus_RGC
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write(6,'(a24,x,e8.1)') 'maxrelaxation_RGC: ',maxdRelax_RGC
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write(6,'(a24,x,e8.1)') 'maxVolDiscrepancy_RGC: ',maxVolDiscr_RGC
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write(6,'(a24,x,e8.1)') 'volDiscrepancyMod_RGC: ',volDiscrMod_RGC
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write(6,'(a24,x,e8.1)') 'discrepancyPower_RGC: ',volDiscrPow_RGC
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write(6,*)
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write(6,'(a24,x,e8.1)') ' aTol_RGC: ',absTol_RGC
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write(6,'(a24,x,e8.1)') ' rTol_RGC: ',relTol_RGC
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write(6,'(a24,x,e8.1)') ' aMax_RGC: ',absMax_RGC
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write(6,'(a24,x,e8.1)') ' rMax_RGC: ',relMax_RGC
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write(6,'(a24,x,e8.1)') ' perturbPenalty_RGC: ',pPert_RGC
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write(6,'(a24,x,e8.1)') ' relevantMismatch_RGC: ',xSmoo_RGC
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write(6,'(a24,x,e8.1)') ' viscosityrate_RGC: ',viscPower_RGC
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write(6,'(a24,x,e8.1)') ' viscositymodulus_RGC: ',viscModus_RGC
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write(6,'(a24,x,e8.1)') ' maxrelaxation_RGC: ',maxdRelax_RGC
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write(6,'(a24,x,e8.1)') ' maxVolDiscrepancy_RGC: ',maxVolDiscr_RGC
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write(6,'(a24,x,e8.1)') ' volDiscrepancyMod_RGC: ',volDiscrMod_RGC
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write(6,'(a24,x,e8.1,/)') ' discrepancyPower_RGC: ',volDiscrPow_RGC
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!* spectral parameters
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write(6,'(a24,x,e8.1)') 'err_div_tol: ',err_div_tol
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write(6,'(a24,x,e8.1)') 'err_stress_tolrel: ',err_stress_tolrel
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write(6,'(a24,x,i8)') 'itmax: ',itmax
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write(6,'(a24,x,L8)') 'memory_efficient: ',memory_efficient
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write(6,'(a24,x,e8.1)') ' err_div_tol: ',err_div_tol
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write(6,'(a24,x,e8.1)') ' err_stress_tolrel: ',err_stress_tolrel
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write(6,'(a24,x,i8)') ' itmax: ',itmax
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write(6,'(a24,x,L8)') ' memory_efficient: ',memory_efficient
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if(fftw_timelimit<0) then
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write(6,'(a24,x,L8)') 'fftw_timelimit: ',.false.
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write(6,'(a24,x,L8)') ' fftw_timelimit: ',.false.
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else
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write(6,'(a24,x,e8.1)') 'fftw_timelimit: ',fftw_timelimit
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write(6,'(a24,x,e8.1)') ' fftw_timelimit: ',fftw_timelimit
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endif
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write(6,'(a24,x,a)') 'fftw_planner_flag: ',trim(fftw_planner_flag)
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write(6,'(a24,x,e8.1)') 'rotation_tol: ',rotation_tol
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write(6,*)
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write(6,'(a24,x,a)') ' fftw_planner_flag: ',trim(fftw_planner_flag)
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write(6,'(a24,x,e8.1)') ' rotation_tol: ',rotation_tol
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write(6,'(a24,x,L8,/)') ' divergence_correction: ',divergence_correction
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!* Random seeding parameters
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write(6,'(a24,x,i16)') 'fixed_seed: ',fixedSeed
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write(6,*)
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write(6,'(a24,x,i16,/)') ' fixed_seed: ',fixedSeed
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!$OMP END CRITICAL (write2out)
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!* openMP parameter
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!$ write(6,'(a24,x,i8)') 'number of threads: ',DAMASK_NumThreadsInt
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!$ write(6,*)
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!$ write(6,'(a24,x,i8,/)') ' number of threads: ',DAMASK_NumThreadsInt
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! sanity check
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if (relevantStrain <= 0.0_pReal) call IO_error(260)
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