Merge branch '23_BasticPETSc_2_PETSc' into development
This commit is contained in:
Martin Diehl
commit
a5b06eb6c8
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@ -1,56 +0,0 @@
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5 header
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seeds_fromRandom v2.0.1-1138-gfcac08c -N 50 -g 128 128 128
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grid a 128 b 128 c 128
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microstructures 50
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randomSeed 3336946323
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0.41823530342173082 0.077759964416919514 0.66113722050248613 189.26108507623661 50.425749120256064 78.019878648192815 47.0
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0.8754300454839713 0.094969845269609401 0.42632522145904467 250.899467172654 33.14582034295529 150.05888748377424 48.0
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0.1950290416819265 0.59474264558516909 0.93298429220138601 232.236367110732 47.258083025548189 34.83912199551915 49.0
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@ -355,8 +355,8 @@ program DAMASK_spectral
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select case (loadCases(1)%ID(field))
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case(FIELD_MECH_ID)
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select case (spectral_solver)
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case (DAMASK_spectral_SolverBasicPETSc_label)
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call basicPETSc_init
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case (DAMASK_spectral_SolverBasic_label)
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call basic_init
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case (DAMASK_spectral_SolverPolarisation_label)
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if(iand(debug_level(debug_spectral),debug_levelBasic)/= 0) &
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@ -513,8 +513,8 @@ program DAMASK_spectral
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select case(loadCases(currentLoadCase)%ID(field))
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case(FIELD_MECH_ID)
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select case (spectral_solver)
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case (DAMASK_spectral_SolverBasicPETSc_label)
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call BasicPETSc_forward (&
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case (DAMASK_spectral_SolverBasic_label)
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call Basic_forward (&
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guess,timeinc,timeIncOld,remainingLoadCaseTime, &
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deformation_BC = loadCases(currentLoadCase)%deformation, &
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stress_BC = loadCases(currentLoadCase)%stress, &
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@ -542,8 +542,8 @@ program DAMASK_spectral
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select case(loadCases(currentLoadCase)%ID(field))
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case(FIELD_MECH_ID)
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select case (spectral_solver)
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case (DAMASK_spectral_SolverBasicPETSc_label)
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solres(field) = BasicPETSC_solution (&
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case (DAMASK_spectral_SolverBasic_label)
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solres(field) = Basic_solution (&
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incInfo,timeinc,timeIncOld, &
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stress_BC = loadCases(currentLoadCase)%stress, &
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rotation_BC = loadCases(currentLoadCase)%rotation)
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@ -2,7 +2,7 @@
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!> @author Pratheek Shanthraj, Max-Planck-Institut für Eisenforschung GmbH
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!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
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!> @author Philip Eisenlohr, Max-Planck-Institut für Eisenforschung GmbH
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!> @brief Basic scheme PETSc solver
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!> @brief Basic scheme solver
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!--------------------------------------------------------------------------------------------------
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module spectral_mech_basic
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#include <petsc/finclude/petscsnes.h>
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@ -22,7 +22,7 @@ module spectral_mech_basic
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private
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character (len=*), parameter, public :: &
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DAMASK_spectral_SolverBasicPETSC_label = 'basic'
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DAMASK_spectral_SolverBasic_label = 'basic'
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!--------------------------------------------------------------------------------------------------
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! derived types
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@ -65,9 +65,9 @@ module spectral_mech_basic
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real(pReal), private, dimension(3,3) :: mask_stress = 0.0_pReal
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public :: &
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basicPETSc_init, &
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basicPETSc_solution, &
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BasicPETSc_forward
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basic_init, &
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basic_solution, &
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basic_forward
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external :: &
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PETScErrorF ! is called in the CHKERRQ macro
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@ -76,7 +76,7 @@ contains
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!--------------------------------------------------------------------------------------------------
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!> @brief allocates all necessary fields and fills them with data, potentially from restart info
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!--------------------------------------------------------------------------------------------------
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subroutine basicPETSc_init
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subroutine basic_init
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#if defined(__GFORTRAN__) || __INTEL_COMPILER >= 1800
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use, intrinsic :: iso_fortran_env, only: &
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compiler_version, &
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@ -124,9 +124,9 @@ subroutine basicPETSc_init
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external :: &
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SNESSetOptionsPrefix, &
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SNESSetConvergenceTest, &
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DMDASNESsetFunctionLocal
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DMDASNESSetFunctionLocal
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write(6,'(/,a)') ' <<<+- DAMASK_spectral_solverBasicPETSc init -+>>>'
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write(6,'(/,a)') ' <<<+- DAMASK_spectral_solverBasic init -+>>>'
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write(6,'(/,a)') ' Shanthraj et al., International Journal of Plasticity, 66:31–45, 2015'
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write(6,'(a,/)') ' https://doi.org/10.1016/j.ijplas.2014.02.006'
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write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
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@ -158,9 +158,9 @@ subroutine basicPETSc_init
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call DMsetFromOptions(da,ierr); CHKERRQ(ierr)
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call DMsetUp(da,ierr); CHKERRQ(ierr)
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call DMcreateGlobalVector(da,solution_vec,ierr); CHKERRQ(ierr) ! global solution vector (grid x 9, i.e. every def grad tensor)
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call DMDASNESsetFunctionLocal(da,INSERT_VALUES,BasicPETSC_formResidual,PETSC_NULL_SNES,ierr) ! residual vector of same shape as solution vector
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call DMDASNESsetFunctionLocal(da,INSERT_VALUES,Basic_formResidual,PETSC_NULL_SNES,ierr) ! residual vector of same shape as solution vector
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CHKERRQ(ierr)
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call SNESsetConvergenceTest(snes,BasicPETSC_converged,PETSC_NULL_SNES,PETSC_NULL_FUNCTION,ierr) ! specify custom convergence check function "_converged"
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call SNESsetConvergenceTest(snes,Basic_converged,PETSC_NULL_SNES,PETSC_NULL_FUNCTION,ierr) ! specify custom convergence check function "_converged"
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CHKERRQ(ierr)
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call SNESsetFromOptions(snes,ierr); CHKERRQ(ierr) ! pull it all together with additional CLI arguments
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@ -212,12 +212,12 @@ subroutine basicPETSc_init
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call Utilities_updateGamma(C_minMaxAvg,.true.)
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end subroutine basicPETSc_init
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end subroutine basic_init
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!--------------------------------------------------------------------------------------------------
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!> @brief solution for the Basic PETSC scheme with internal iterations
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!> @brief solution for the Basic scheme with internal iterations
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!--------------------------------------------------------------------------------------------------
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type(tSolutionState) function basicPETSc_solution(incInfoIn,timeinc,timeinc_old,stress_BC,rotation_BC)
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type(tSolutionState) function basic_solution(incInfoIn,timeinc,timeinc_old,stress_BC,rotation_BC)
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use IO, only: &
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IO_error
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use numerics, only: &
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@ -275,19 +275,19 @@ type(tSolutionState) function basicPETSc_solution(incInfoIn,timeinc,timeinc_old,
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! check convergence
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call SNESGetConvergedReason(snes,reason,ierr); CHKERRQ(ierr)
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BasicPETSc_solution%converged = reason > 0
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basicPETSC_solution%iterationsNeeded = totalIter
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basicPETSc_solution%termIll = terminallyIll
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basic_solution%converged = reason > 0
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basic_solution%iterationsNeeded = totalIter
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basic_solution%termIll = terminallyIll
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terminallyIll = .false.
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if (reason == -4) call IO_error(893_pInt) ! MPI error
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end function BasicPETSc_solution
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end function basic_solution
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!--------------------------------------------------------------------------------------------------
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!> @brief forms the basic residual vector
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!--------------------------------------------------------------------------------------------------
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subroutine BasicPETSC_formResidual(in,x_scal,f_scal,dummy,ierr)
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subroutine Basic_formResidual(in,x_scal,f_scal,dummy,ierr)
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use numerics, only: &
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itmax, &
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itmin
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@ -370,13 +370,13 @@ subroutine BasicPETSC_formResidual(in,x_scal,f_scal,dummy,ierr)
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! constructing residual
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f_scal = tensorField_real(1:3,1:3,1:grid(1),1:grid(2),1:grid3) ! Gamma*P gives correction towards div(P) = 0, so needs to be zero, too
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end subroutine BasicPETSc_formResidual
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end subroutine Basic_formResidual
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!--------------------------------------------------------------------------------------------------
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!> @brief convergence check
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!--------------------------------------------------------------------------------------------------
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subroutine BasicPETSc_converged(snes_local,PETScIter,xnorm,snorm,fnorm,reason,dummy,ierr)
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subroutine Basic_converged(snes_local,PETScIter,xnorm,snorm,fnorm,reason,dummy,ierr)
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use numerics, only: &
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itmax, &
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itmin, &
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@ -425,14 +425,14 @@ subroutine BasicPETSc_converged(snes_local,PETScIter,xnorm,snorm,fnorm,reason,du
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write(6,'(/,a)') ' ==========================================================================='
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flush(6)
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end subroutine BasicPETSc_converged
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end subroutine Basic_converged
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!--------------------------------------------------------------------------------------------------
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!> @brief forwarding routine
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!> @details find new boundary conditions and best F estimate for end of current timestep
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!> possibly writing restart information, triggering of state increment in DAMASK, and updating of IPcoordinates
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!--------------------------------------------------------------------------------------------------
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subroutine BasicPETSc_forward(guess,timeinc,timeinc_old,loadCaseTime,deformation_BC,stress_BC,rotation_BC)
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subroutine Basic_forward(guess,timeinc,timeinc_old,loadCaseTime,deformation_BC,stress_BC,rotation_BC)
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use math, only: &
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math_mul33x33 ,&
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math_rotate_backward33
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@ -538,6 +538,6 @@ subroutine BasicPETSc_forward(guess,timeinc,timeinc_old,loadCaseTime,deformation
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math_rotate_backward33(F_aim,rotation_BC)),[9,grid(1),grid(2),grid3])
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call DMDAVecRestoreArrayF90(da,solution_vec,F,ierr); CHKERRQ(ierr)
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end subroutine BasicPETSc_forward
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end subroutine Basic_forward
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end module spectral_mech_basic
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