223031012
/
DAMASK_EICMD
mirror of https://github.com/achalhp/DAMASK_EICMD.git
1
0
Fork 0
Code Issues Projects Releases Wiki Activity

harmonize status reporting

This commit is contained in:
Martin Diehl 2024-01-09 14:43:13 +01:00
parent 5e7565f99f
commit 48a38f3cf5
No known key found for this signature in database
GPG Key ID: 1FD50837275A0A9B
4 changed files with 24 additions and 24 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

14
src/grid/grid_mech_FEM.f90
View File

@ -28,7 +28,7 @@ module grid_mechanical_FEM
use homogenization use homogenization
use discretization use discretization
use discretization_grid use discretization_grid
use constants
#if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY) #if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY)
implicit none(type,external) implicit none(type,external)
@ -84,7 +84,7 @@ module grid_mechanical_FEM
err_BC !< deviation from stress BC err_BC !< deviation from stress BC
integer :: totalIter = 0 !< total iteration in current increment integer :: totalIter = 0 !< total iteration in current increment
logical :: broken integer(kind(STATUS_OK)) :: status
public :: & public :: &
grid_mechanical_FEM_init, & grid_mechanical_FEM_init, &
@ -271,7 +271,7 @@ subroutine grid_mechanical_FEM_init(num_grid)
end if restartRead end if restartRead
call utilities_updateCoords(F) call utilities_updateCoords(F)
call utilities_constitutiveResponse(broken,P_current,P_av,C_volAvg,devNull, & ! stress field, stress avg, global average of stiffness and (min+max)/2 call utilities_constitutiveResponse(status,P_current,P_av,C_volAvg,devNull, & ! stress field, stress avg, global average of stiffness and (min+max)/2
F, & ! target F F, & ! target F
0.0_pREAL) ! time increment 0.0_pREAL) ! time increment
call DMDAVecRestoreArrayF90(DM_mech,u_PETSc,u,err_PETSc) call DMDAVecRestoreArrayF90(DM_mech,u_PETSc,u,err_PETSc)
@ -325,7 +325,7 @@ function grid_mechanical_FEM_solution(incInfoIn) result(solution)
solution%converged = reason > 0 solution%converged = reason > 0
solution%iterationsNeeded = totalIter solution%iterationsNeeded = totalIter
solution%termIll = broken solution%termIll = STATUS_OK /= status
P_aim = merge(P_av,P_aim,params%stress_mask) P_aim = merge(P_av,P_aim,params%stress_mask)
end function grid_mechanical_FEM_solution end function grid_mechanical_FEM_solution
@ -492,7 +492,7 @@ subroutine converged(snes_local,PETScIter,devNull1,devNull2,fnorm,reason,dummy,e
BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol) BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol)
if ((totalIter >= num%itmin .and. all([err_div/divTol, err_BC/BCTol] < 1.0_pREAL)) & if ((totalIter >= num%itmin .and. all([err_div/divTol, err_BC/BCTol] < 1.0_pREAL)) &
.or. broken) then .or. STATUS_OK /= status) then
reason = 1 reason = 1
elseif (totalIter >= num%itmax) then elseif (totalIter >= num%itmax) then
reason = -1 reason = -1
@ -570,10 +570,10 @@ subroutine formResidual(da_local,x_local, &
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! evaluate constitutive response ! evaluate constitutive response
call utilities_constitutiveResponse(broken,P_current,& call utilities_constitutiveResponse(status,P_current,&
P_av,C_volAvg,devNull, & P_av,C_volAvg,devNull, &
F,params%Delta_t,params%rotation_BC) F,params%Delta_t,params%rotation_BC)
call MPI_Allreduce(MPI_IN_PLACE,broken,1_MPI_INTEGER_KIND,MPI_LOGICAL,MPI_LOR,MPI_COMM_WORLD,err_MPI) call MPI_Allreduce(MPI_IN_PLACE,status,1_MPI_INTEGER_KIND,MPI_INTEGER,MPI_SUM,MPI_COMM_WORLD,err_MPI)
call parallelization_chkerr(err_MPI) call parallelization_chkerr(err_MPI)
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------

13
src/grid/grid_mech_spectral_basic.f90
View File

@ -26,6 +26,7 @@ module grid_mechanical_spectral_basic
use grid_mech_utilities use grid_mech_utilities
use homogenization use homogenization
use discretization_grid use discretization_grid
use constants
#if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY) #if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY)
implicit none(type,external) implicit none(type,external)
@ -84,7 +85,7 @@ module grid_mechanical_spectral_basic
err_div !< RMS of div of P err_div !< RMS of div of P
integer :: totalIter = 0 !< total iteration in current increment integer :: totalIter = 0 !< total iteration in current increment
logical :: broken integer(kind(STATUS_OK)) :: status
public :: & public :: &
grid_mechanical_spectral_basic_init, & grid_mechanical_spectral_basic_init, &
@ -228,7 +229,7 @@ subroutine grid_mechanical_spectral_basic_init(num_grid)
end if restartRead end if restartRead
call utilities_updateCoords(reshape(F,shape(F_lastInc))) call utilities_updateCoords(reshape(F,shape(F_lastInc)))
call utilities_constitutiveResponse(broken,P,P_av,C_volAvg,C_minMaxAvg, & ! stress field, stress avg, global average of stiffness and (min+max)/2 call utilities_constitutiveResponse(status,P,P_av,C_volAvg,C_minMaxAvg, & ! stress field, stress avg, global average of stiffness and (min+max)/2
reshape(F,shape(F_lastInc)), & ! target F reshape(F,shape(F_lastInc)), & ! target F
0.0_pREAL) ! time increment 0.0_pREAL) ! time increment
call DMDAVecRestoreArrayF90(DM_mech,F_PETSc,F,err_PETSc) ! deassociate pointer call DMDAVecRestoreArrayF90(DM_mech,F_PETSc,F,err_PETSc) ! deassociate pointer
@ -287,7 +288,7 @@ function grid_mechanical_spectral_basic_solution(incInfoIn) result(solution)
solution%converged = reason > 0 solution%converged = reason > 0
solution%iterationsNeeded = totalIter solution%iterationsNeeded = totalIter
solution%termIll = broken solution%termIll = STATUS_OK /= status
P_aim = merge(P_av,P_aim,params%stress_mask) P_aim = merge(P_av,P_aim,params%stress_mask)
end function grid_mechanical_spectral_basic_solution end function grid_mechanical_spectral_basic_solution
@ -452,7 +453,7 @@ subroutine converged(snes_local,PETScIter,devNull1,devNull2,devNull3,reason,dumm
BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol) BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol)
if ((totalIter >= num%itmin .and. all([err_div/divTol, err_BC/BCTol] < 1.0_pREAL)) & if ((totalIter >= num%itmin .and. all([err_div/divTol, err_BC/BCTol] < 1.0_pREAL)) &
.or. broken) then .or. STATUS_OK /= status) then
reason = 1 reason = 1
elseif (totalIter >= num%itmax) then elseif (totalIter >= num%itmax) then
reason = -1 reason = -1
@ -514,10 +515,10 @@ subroutine formResidual(residual_subdomain, F, &
end if newIteration end if newIteration
associate (P => r) associate (P => r)
call utilities_constitutiveResponse(broken,P, & call utilities_constitutiveResponse(status,P, &
P_av,C_volAvg,C_minMaxAvg, & P_av,C_volAvg,C_minMaxAvg, &
F,params%Delta_t,params%rotation_BC) F,params%Delta_t,params%rotation_BC)
call MPI_Allreduce(MPI_IN_PLACE,broken,1_MPI_INTEGER_KIND,MPI_LOGICAL,MPI_LOR,MPI_COMM_WORLD,err_MPI) call MPI_Allreduce(MPI_IN_PLACE,status,1_MPI_INTEGER_KIND,MPI_INTEGER,MPI_SUM,MPI_COMM_WORLD,err_MPI)
call parallelization_chkerr(err_MPI) call parallelization_chkerr(err_MPI)
err_div = utilities_divergenceRMS(P) err_div = utilities_divergenceRMS(P)
end associate end associate

15
src/grid/grid_mech_spectral_polarization.f90
View File

@ -27,6 +27,7 @@ module grid_mechanical_spectral_polarization
use config use config
use homogenization use homogenization
use discretization_grid use discretization_grid
use constants
#if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY) #if (PETSC_VERSION_MAJOR==3 && PETSC_VERSION_MINOR>14) && !defined(PETSC_HAVE_MPI_F90MODULE_VISIBILITY)
implicit none(type,external) implicit none(type,external)
@ -96,7 +97,7 @@ module grid_mechanical_spectral_polarization
err_div !< RMS of div of P err_div !< RMS of div of P
integer :: totalIter = 0 !< total iteration in current increment integer :: totalIter = 0 !< total iteration in current increment
logical :: broken integer(kind(STATUS_OK)) :: status
public :: & public :: &
grid_mechanical_spectral_polarization_init, & grid_mechanical_spectral_polarization_init, &
@ -257,7 +258,7 @@ subroutine grid_mechanical_spectral_polarization_init(num_grid)
end if restartRead end if restartRead
call utilities_updateCoords(reshape(F,shape(F_lastInc))) call utilities_updateCoords(reshape(F,shape(F_lastInc)))
call utilities_constitutiveResponse(broken,P,P_av,C_volAvg,C_minMaxAvg, & ! stress field, stress avg, global average of stiffness and (min+max)/2 call utilities_constitutiveResponse(status,P,P_av,C_volAvg,C_minMaxAvg, & ! stress field, stress avg, global average of stiffness and (min+max)/2
reshape(F,shape(F_lastInc)), & ! target F reshape(F,shape(F_lastInc)), & ! target F
0.0_pREAL) ! time increment 0.0_pREAL) ! time increment
call DMDAVecRestoreArrayF90(DM_mech,FandF_tau_PETSc,FandF_tau,err_PETSc) ! deassociate pointer call DMDAVecRestoreArrayF90(DM_mech,FandF_tau_PETSc,FandF_tau,err_PETSc) ! deassociate pointer
@ -322,7 +323,7 @@ function grid_mechanical_spectral_polarization_solution(incInfoIn) result(soluti
solution%converged = reason > 0 solution%converged = reason > 0
solution%iterationsNeeded = totalIter solution%iterationsNeeded = totalIter
solution%termIll = broken solution%termIll = STATUS_OK /= status
P_aim = merge(P_av,P_aim,params%stress_mask) P_aim = merge(P_av,P_aim,params%stress_mask)
end function grid_mechanical_spectral_polarization_solution end function grid_mechanical_spectral_polarization_solution
@ -516,7 +517,7 @@ subroutine converged(snes_local,PETScIter,devNull1,devNull2,devNull3,reason,dumm
BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol) BCTol = max(maxval(abs(P_av))*num%eps_stress_rtol, num%eps_stress_atol)
if ((totalIter >= num%itmin .and. all([err_div/divTol, err_curl/curlTol, err_BC/BCTol] < 1.0_pREAL)) & if ((totalIter >= num%itmin .and. all([err_div/divTol, err_curl/curlTol, err_BC/BCTol] < 1.0_pREAL)) &
.or. broken) then .or. STATUS_OK /= status) then
reason = 1 reason = 1
elseif (totalIter >= num%itmax) then elseif (totalIter >= num%itmax) then
reason = -1 reason = -1
@ -604,14 +605,14 @@ subroutine formResidual(residual_subdomain, FandF_tau, &
err_curl = utilities_curlRMS(F) err_curl = utilities_curlRMS(F)
#ifdef __GFORTRAN__ #ifdef __GFORTRAN__
call utilities_constitutiveResponse(broken,r_F, & call utilities_constitutiveResponse(status,r_F, &
#else #else
associate (P => r_F) associate (P => r_F)
call utilities_constitutiveResponse(broken, P, & call utilities_constitutiveResponse(status, P, &
#endif #endif
P_av,C_volAvg,C_minMaxAvg, & P_av,C_volAvg,C_minMaxAvg, &
F - r_F_tau/num%beta,params%Delta_t,params%rotation_BC) F - r_F_tau/num%beta,params%Delta_t,params%rotation_BC)
call MPI_Allreduce(MPI_IN_PLACE,broken,1_MPI_INTEGER_KIND,MPI_LOGICAL,MPI_LOR,MPI_COMM_WORLD,err_MPI) call MPI_Allreduce(MPI_IN_PLACE,status,1_MPI_INTEGER_KIND,MPI_INTEGER,MPI_SUM,MPI_COMM_WORLD,err_MPI)
#ifdef __GFORTRAN__ #ifdef __GFORTRAN__
err_div = utilities_divergenceRMS(r_F) err_div = utilities_divergenceRMS(r_F)
#else #else

6
src/grid/grid_mech_utilities.f90
View File

@ -113,10 +113,10 @@ end function utilities_maskedCompliance
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
!> @brief Calculate constitutive response. !> @brief Calculate constitutive response.
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
subroutine utilities_constitutiveResponse(broken, P,P_av,C_volAvg,C_minmaxAvg,& subroutine utilities_constitutiveResponse(status, P,P_av,C_volAvg,C_minmaxAvg,&
F,Delta_t,rotation_BC) F,Delta_t,rotation_BC)
logical, intent(out) :: broken integer(kind(STATUS_OK)), intent(out) :: status
real(pREAL), intent(out), dimension(3,3,3,3) :: C_volAvg, C_minmaxAvg !< average stiffness real(pREAL), intent(out), dimension(3,3,3,3) :: C_volAvg, C_minmaxAvg !< average stiffness
real(pREAL), intent(out), dimension(3,3) :: P_av !< average PK stress real(pREAL), intent(out), dimension(3,3) :: P_av !< average PK stress
real(pREAL), intent(out), dimension(3,3,cells(1),cells(2),cells3) :: P !< PK stress real(pREAL), intent(out), dimension(3,3,cells(1),cells(2),cells3) :: P !< PK stress
@ -129,7 +129,6 @@ subroutine utilities_constitutiveResponse(broken, P,P_av,C_volAvg,C_minmaxAvg,&
real(pREAL), dimension(3,3,3,3) :: dPdF_max, dPdF_min real(pREAL), dimension(3,3,3,3) :: dPdF_max, dPdF_min
real(pREAL) :: dPdF_norm_max, dPdF_norm_min real(pREAL) :: dPdF_norm_max, dPdF_norm_min
real(pREAL), dimension(2) :: valueAndRank !< pair of min/max norm of dPdF to synchronize min/max of dPdF real(pREAL), dimension(2) :: valueAndRank !< pair of min/max norm of dPdF to synchronize min/max of dPdF
integer(kind(STATUS_OK)) :: status
print'(/,1x,a)', '... evaluating constitutive response ......................................' print'(/,1x,a)', '... evaluating constitutive response ......................................'
@ -138,7 +137,6 @@ subroutine utilities_constitutiveResponse(broken, P,P_av,C_volAvg,C_minmaxAvg,&
homogenization_F = reshape(F,[3,3,product(cells(1:2))*cells3]) ! set materialpoint target F to estimated field homogenization_F = reshape(F,[3,3,product(cells(1:2))*cells3]) ! set materialpoint target F to estimated field
call homogenization_mechanical_response(status,Delta_t,1,product(cells(1:2))*cells3) ! calculate P field call homogenization_mechanical_response(status,Delta_t,1,product(cells(1:2))*cells3) ! calculate P field
broken = STATUS_OK /= status
P = reshape(homogenization_P, [3,3,cells(1),cells(2),cells3]) P = reshape(homogenization_P, [3,3,cells(1),cells(2),cells3])
P_av = sum(sum(sum(P,dim=5),dim=4),dim=3) * wgt P_av = sum(sum(sum(P,dim=5),dim=4),dim=3) * wgt