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Merge branch 'YAML-compatible-debug' into 'development' 

Yaml compatible debug

See merge request damask/DAMASK!187
This commit is contained in:
Franz Roters 2020-07-07 13:41:40 +02:00
parent f43bed6f10 48b42debe0
commit 0a2d30463c
39 changed files with 342 additions and 414 deletions
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2
PRIVATE

@ -1 +1 @@
Subproject commit 464a0ebaf2e842d50d84a32c740638b25ae11354 Subproject commit 3fc9d58a35614fd8ffa1179e634431eb457d0150

38
src/CPFEM.f90
View File

@ -51,6 +51,18 @@ module CPFEM
type(tNumerics), private :: num type(tNumerics), private :: num
type, private :: tDebugOptions
logical :: &
basic, &
extensive, &
selective
integer:: &
element, &
ip
end type tDebugOptions
type(tDebugOptions), private :: debugCPFEM
public :: & public :: &
CPFEM_general, & CPFEM_general, &
CPFEM_initAll, & CPFEM_initAll, &
@ -93,7 +105,8 @@ end subroutine CPFEM_initAll
subroutine CPFEM_init subroutine CPFEM_init
class(tNode), pointer :: & class(tNode), pointer :: &
num_commercialFEM num_commercialFEM, &
debug_CPFEM
write(6,'(/,a)') ' <<<+- CPFEM init -+>>>' write(6,'(/,a)') ' <<<+- CPFEM init -+>>>'
flush(6) flush(6)
@ -107,9 +120,18 @@ subroutine CPFEM_init
num_commercialFEM => numerics_root%get('commercialFEM',defaultVal=emptyDict) num_commercialFEM => numerics_root%get('commercialFEM',defaultVal=emptyDict)
num%iJacoStiffness = num_commercialFEM%get_asInt('ijacostiffness',defaultVal=1) num%iJacoStiffness = num_commercialFEM%get_asInt('ijacostiffness',defaultVal=1)
if (num%iJacoStiffness < 1) call IO_error(301,ext_msg='iJacoStiffness') if (num%iJacoStiffness < 1) call IO_error(301,ext_msg='iJacoStiffness')
!------------------------------------------------------------------------------
if (iand(debug_level(debug_CPFEM), debug_levelBasic) /= 0) then !------------------------------------------------------------------------------
! read debug options
debug_CPFEM => debug_root%get('cpfem',defaultVal=emptyList)
debugCPFEM%basic = debug_CPFEM%contains('basic')
debugCPFEM%extensive = debug_CPFEM%contains('extensive')
debugCPFEM%selective = debug_CPFEM%contains('selective')
debugCPFEM%element = debug_root%get_asInt('element',defaultVal = 1)
debugCPFEM%ip = debug_root%get_asInt('integrationpoint',defaultVal = 1)
if(debugCPFEM%basic) then
write(6,'(a32,1x,6(i8,1x))') 'CPFEM_cs: ', shape(CPFEM_cs) write(6,'(a32,1x,6(i8,1x))') 'CPFEM_cs: ', shape(CPFEM_cs)
write(6,'(a32,1x,6(i8,1x))') 'CPFEM_dcsdE: ', shape(CPFEM_dcsdE) write(6,'(a32,1x,6(i8,1x))') 'CPFEM_dcsdE: ', shape(CPFEM_dcsdE)
write(6,'(a32,1x,6(i8,1x),/)') 'CPFEM_dcsdE_knownGood: ', shape(CPFEM_dcsdE_knownGood) write(6,'(a32,1x,6(i8,1x),/)') 'CPFEM_dcsdE_knownGood: ', shape(CPFEM_dcsdE_knownGood)
@ -150,8 +172,7 @@ subroutine CPFEM_general(mode, ffn, ffn1, temperature_inp, dt, elFE, ip, cauchyS
elCP = mesh_FEM2DAMASK_elem(elFE) elCP = mesh_FEM2DAMASK_elem(elFE)
if (iand(debug_level(debug_CPFEM), debug_levelBasic) /= 0_pInt & if (debugCPFEM%basic .and. elCP == debugCPFEM%element .and. ip == debugCPFEM%ip) then
.and. elCP == debug_e .and. ip == debug_i) then
write(6,'(/,a)') '#############################################' write(6,'(/,a)') '#############################################'
write(6,'(a1,a22,1x,i8,a13)') '#','element', elCP, '#' write(6,'(a1,a22,1x,i8,a13)') '#','element', elCP, '#'
write(6,'(a1,a22,1x,i8,a13)') '#','ip', ip, '#' write(6,'(a1,a22,1x,i8,a13)') '#','ip', ip, '#'
@ -189,7 +210,7 @@ subroutine CPFEM_general(mode, ffn, ffn1, temperature_inp, dt, elFE, ip, cauchyS
updateJaco = mod(cycleCounter,num%iJacoStiffness) == 0 updateJaco = mod(cycleCounter,num%iJacoStiffness) == 0
FEsolving_execElem = elCP FEsolving_execElem = elCP
FEsolving_execIP = ip FEsolving_execIP = ip
if (iand(debug_level(debug_CPFEM), debug_levelExtensive) /= 0_pInt) & if (debugCPFEM%extensive) &
write(6,'(a,i8,1x,i2)') '<< CPFEM >> calculation for elFE ip ',elFE,ip write(6,'(a,i8,1x,i2)') '<< CPFEM >> calculation for elFE ip ',elFE,ip
call materialpoint_stressAndItsTangent(updateJaco, dt) call materialpoint_stressAndItsTangent(updateJaco, dt)
@ -226,9 +247,8 @@ subroutine CPFEM_general(mode, ffn, ffn1, temperature_inp, dt, elFE, ip, cauchyS
endif terminalIllness endif terminalIllness
endif validCalculation endif validCalculation
if ((iand(debug_level(debug_CPFEM), debug_levelExtensive) /= 0_pInt) & if (debugCPFEM%extensive &
.and. ((debug_e == elCP .and. debug_i == ip) & .and. (debugCPFEM%element == elCP .and. debugCPFEM%ip == ip) .or. .not. debugCPFEM%selective) then
.or. .not. iand(debug_level(debug_CPFEM), debug_levelSelective) /= 0_pInt)) then
write(6,'(a,i8,1x,i2,/,12x,6(f10.3,1x)/)') & write(6,'(a,i8,1x,i2,/,12x,6(f10.3,1x)/)') &
'<< CPFEM >> stress/MPa at elFE ip ', elFE, ip, CPFEM_cs(1:6,ip,elCP)*1.0e-6_pReal '<< CPFEM >> stress/MPa at elFE ip ', elFE, ip, CPFEM_cs(1:6,ip,elCP)*1.0e-6_pReal
write(6,'(a,i8,1x,i2,/,6(12x,6(f10.3,1x)/))') & write(6,'(a,i8,1x,i2,/,6(12x,6(f10.3,1x)/))') &

10
src/DAMASK_marc.f90
View File

@ -176,6 +176,7 @@ subroutine hypela2(d,g,e,de,s,t,dt,ngens,m,nn,kcus,matus,ndi,nshear,disp, &
use prec use prec
use DAMASK_interface use DAMASK_interface
use numerics use numerics
use YAML_types
use FEsolving use FEsolving
use debug use debug
use discretization_marc use discretization_marc
@ -252,9 +253,12 @@ subroutine hypela2(d,g,e,de,s,t,dt,ngens,m,nn,kcus,matus,ndi,nshear,disp, &
logical, save :: & logical, save :: &
lastIncConverged = .false., & !< needs description lastIncConverged = .false., & !< needs description
outdatedByNewInc = .false., & !< needs description outdatedByNewInc = .false., & !< needs description
CPFEM_init_done = .false. !< remember whether init has been done already CPFEM_init_done = .false., & !< remember whether init has been done already
debug_basic = .true.
class(tNode), pointer :: &
debug_Marc ! pointer to Marc debug options
if (iand(debug_level(debug_MARC),debug_LEVELBASIC) /= 0) then if(debug_basic) then
write(6,'(a,/,i8,i8,i2)') ' MSC.MARC information on shape of element(2), IP:', m, nn write(6,'(a,/,i8,i8,i2)') ' MSC.MARC information on shape of element(2), IP:', m, nn
write(6,'(a,2(i1))') ' Jacobian: ', ngens,ngens write(6,'(a,2(i1))') ' Jacobian: ', ngens,ngens
write(6,'(a,i1)') ' Direct stress: ', ndi write(6,'(a,i1)') ' Direct stress: ', ndi
@ -275,6 +279,8 @@ subroutine hypela2(d,g,e,de,s,t,dt,ngens,m,nn,kcus,matus,ndi,nshear,disp, &
if (.not. CPFEM_init_done) then if (.not. CPFEM_init_done) then
CPFEM_init_done = .true. CPFEM_init_done = .true.
call CPFEM_initAll call CPFEM_initAll
debug_Marc => debug_root%get('marc',defaultVal=emptyList)
debug_basic = debug_Marc%contains('basic')
endif endif
computationMode = 0 ! save initialization value, since it does not result in any calculation computationMode = 0 ! save initialization value, since it does not result in any calculation

38
src/config.f90
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@ -4,7 +4,6 @@
!> @details Reads the material configuration file, where solverJobName.materialConfig takes !> @details Reads the material configuration file, where solverJobName.materialConfig takes
!! precedence over material.config. Stores the raw strings and the positions of delimiters for the !! precedence over material.config. Stores the raw strings and the positions of delimiters for the
!! parts 'homogenization', 'crystallite', 'phase', 'texture', and 'microstucture' !! parts 'homogenization', 'crystallite', 'phase', 'texture', and 'microstucture'
!! Reads numerics.config and debug.config
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module config module config
use prec use prec
@ -25,9 +24,6 @@ module config
config_texture, & config_texture, &
config_crystallite config_crystallite
type(tPartitionedStringList), public, protected :: &
config_debug
character(len=pStringLen), public, protected, allocatable, dimension(:) :: & character(len=pStringLen), public, protected, allocatable, dimension(:) :: &
config_name_phase, & !< name of each phase config_name_phase, & !< name of each phase
config_name_homogenization, & !< name of each homogenization config_name_homogenization, & !< name of each homogenization
@ -53,11 +49,14 @@ subroutine config_init
line, & line, &
part part
character(len=pStringLen), dimension(:), allocatable :: fileContent character(len=pStringLen), dimension(:), allocatable :: fileContent
logical :: fileExists class(tNode), pointer :: &
debug_material
logical :: fileExists
write(6,'(/,a)') ' <<<+- config init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- config init -+>>>'; flush(6)
verbose = iand(debug_level(debug_material),debug_levelBasic) /= 0 debug_material => debug_root%get('material',defaultVal=emptyList)
verbose = debug_material%contains('basic')
inquire(file=trim(getSolverJobName())//'.materialConfig',exist=fileExists) inquire(file=trim(getSolverJobName())//'.materialConfig',exist=fileExists)
if(fileExists) then if(fileExists) then
@ -110,13 +109,6 @@ subroutine config_init
call IO_error(160,ext_msg='<texture>') call IO_error(160,ext_msg='<texture>')
inquire(file='debug.config', exist=fileExists)
if (fileExists) then
write(6,'(/,a)') ' reading debug.config'; flush(6)
fileContent = IO_read_ASCII('debug.config')
call parse_debugAndNumericsConfig(config_debug,fileContent)
endif
contains contains
@ -238,23 +230,6 @@ subroutine parse_materialConfig(sectionNames,part,line, &
end subroutine parse_materialConfig end subroutine parse_materialConfig
!--------------------------------------------------------------------------------------------------
!> @brief parses the material.config file
!--------------------------------------------------------------------------------------------------
subroutine parse_debugAndNumericsConfig(config_list, &
fileContent)
type(tPartitionedStringList), intent(out) :: config_list
character(len=pStringLen), dimension(:), intent(in) :: fileContent
integer :: i
do i = 1, size(fileContent)
call config_list%add(trim(adjustl(fileContent(i))))
enddo
end subroutine parse_debugAndNumericsConfig
end subroutine config_init end subroutine config_init
@ -279,9 +254,6 @@ subroutine config_deallocate(what)
case('material.config/texture') case('material.config/texture')
deallocate(config_texture) deallocate(config_texture)
case('debug.config')
call config_debug%free
case default case default
call IO_error(0,ext_msg='config_deallocate') call IO_error(0,ext_msg='config_deallocate')

24
src/constitutive.f90
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@ -317,6 +317,20 @@ module constitutive
end interface end interface
type :: tDebugOptions
logical :: &
basic, &
extensive, &
selective
integer :: &
element, &
ip, &
grain
end type tDebugOptions
type(tDebugOptions) :: debugConstitutive
public :: & public :: &
plastic_nonlocal_updateCompatibility, & plastic_nonlocal_updateCompatibility, &
constitutive_init, & constitutive_init, &
@ -341,6 +355,16 @@ subroutine constitutive_init
integer :: & integer :: &
ph, & !< counter in phase loop ph, & !< counter in phase loop
s !< counter in source loop s !< counter in source loop
class (tNode), pointer :: &
debug_constitutive
debug_constitutive => debug_root%get('constitutive', defaultVal=emptyList)
debugConstitutive%basic = debug_constitutive%contains('basic')
debugConstitutive%extensive = debug_constitutive%contains('extensive')
debugConstitutive%selective = debug_constitutive%contains('selective')
debugConstitutive%element = debug_root%get_asInt('element',defaultVal = 1)
debugConstitutive%ip = debug_root%get_asInt('integrationpoint',defaultVal = 1)
debugConstitutive%grain = debug_root%get_asInt('grain',defaultVal = 1)
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! initialized plasticity ! initialized plasticity

5
src/constitutive_plastic_disloUCLA.f90
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@ -91,14 +91,13 @@ module subroutine plastic_disloUCLA_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
extmsg = '' extmsg = ''
write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_DISLOUCLA_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_DISLOUCLA_LABEL//' init -+>>>'
write(6,'(/,a)') ' Cereceda et al., International Journal of Plasticity 78:242–256, 2016' write(6,'(/,a)') ' Cereceda et al., International Journal of Plasticity 78:242–256, 2016'
write(6,'(a)') ' https://dx.doi.org/10.1016/j.ijplas.2015.09.002' write(6,'(a)') ' https://dx.doi.org/10.1016/j.ijplas.2015.09.002'
Ninstance = count(phase_plasticity == PLASTICITY_DISLOUCLA_ID) Ninstance = count(phase_plasticity == PLASTICITY_DISLOUCLA_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))

6
src/constitutive_plastic_dislotwin.f90
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@ -138,7 +138,7 @@ module subroutine plastic_dislotwin_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
extmsg = '' extmsg = ''
write(6,'(/,a)') ' <<<+- constitutive_'//PLASTICITY_DISLOTWIN_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- constitutive_'//PLASTICITY_DISLOTWIN_LABEL//' init -+>>>'
write(6,'(/,a)') ' Ma and Roters, Acta Materialia 52(12):3603–3612, 2004' write(6,'(/,a)') ' Ma and Roters, Acta Materialia 52(12):3603–3612, 2004'
write(6,'(a)') ' https://doi.org/10.1016/j.actamat.2004.04.012' write(6,'(a)') ' https://doi.org/10.1016/j.actamat.2004.04.012'
@ -150,9 +150,7 @@ module subroutine plastic_dislotwin_init
write(6,'(a,/)') ' https://doi.org/10.1016/j.actamat.2016.07.032' write(6,'(a,/)') ' https://doi.org/10.1016/j.actamat.2016.07.032'
Ninstance = count(phase_plasticity == PLASTICITY_DISLOTWIN_ID) Ninstance = count(phase_plasticity == PLASTICITY_DISLOTWIN_ID)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) &
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))

15
src/constitutive_plastic_isotropic.f90
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@ -61,14 +61,13 @@ module subroutine plastic_isotropic_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
extmsg = '' extmsg = ''
write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_ISOTROPIC_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_ISOTROPIC_LABEL//' init -+>>>'
write(6,'(/,a)') ' Maiti and Eisenlohr, Scripta Materialia 145:37–40, 2018' write(6,'(/,a)') ' Maiti and Eisenlohr, Scripta Materialia 145:37–40, 2018'
write(6,'(a)') ' https://doi.org/10.1016/j.scriptamat.2017.09.047' write(6,'(a)') ' https://doi.org/10.1016/j.scriptamat.2017.09.047'
Ninstance = count(phase_plasticity == PLASTICITY_ISOTROPIC_ID) Ninstance = count(phase_plasticity == PLASTICITY_ISOTROPIC_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))
@ -84,8 +83,8 @@ module subroutine plastic_isotropic_init
prm%output = config%getStrings('(output)',defaultVal=emptyStringArray) prm%output = config%getStrings('(output)',defaultVal=emptyStringArray)
#ifdef DEBUG #ifdef DEBUG
if (p==material_phaseAt(debug_g,debug_e)) & if (p==material_phaseAt(debugConstitutive%grain,debugConstitutive%element)) &
prm%of_debug = material_phasememberAt(debug_g,debug_i,debug_e) prm%of_debug = material_phasememberAt(debugConstitutive%grain,debugConstitutive%ip,debugConstitutive%element)
#endif #endif
xi_0 = config%getFloat('tau0') xi_0 = config%getFloat('tau0')
@ -183,8 +182,7 @@ module subroutine plastic_isotropic_LpAndItsTangent(Lp,dLp_dMp,Mp,instance,of)
Lp = dot_gamma/prm%M * Mp_dev/norm_Mp_dev Lp = dot_gamma/prm%M * Mp_dev/norm_Mp_dev
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive), debug_levelExtensive) /= 0 & if (debugConstitutive%extensive .and. (of == prm%of_debug .or. .not. debugConstitutive%selective)) then
.and. (of == prm%of_debug .or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0)) then
write(6,'(/,a,/,3(12x,3(f12.4,1x)/))') '<< CONST isotropic >> Tstar (dev) / MPa', & write(6,'(/,a,/,3(12x,3(f12.4,1x)/))') '<< CONST isotropic >> Tstar (dev) / MPa', &
transpose(Mp_dev)*1.0e-6_pReal transpose(Mp_dev)*1.0e-6_pReal
write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> norm Tstar / MPa', norm_Mp_dev*1.0e-6_pReal write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> norm Tstar / MPa', norm_Mp_dev*1.0e-6_pReal
@ -239,8 +237,7 @@ module subroutine plastic_isotropic_LiAndItsTangent(Li,dLi_dMi,Mi,instance,of)
* tr * abs(tr)**(prm%n-1.0_pReal) * tr * abs(tr)**(prm%n-1.0_pReal)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive), debug_levelExtensive) /= 0 & if (debugConstitutive%extensive .and. (of == prm%of_debug .or. .not. debugConstitutive%selective)) then
.and. (of == prm%of_debug .or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0)) then
write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> pressure / MPa', tr/3.0_pReal*1.0e-6_pReal write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> pressure / MPa', tr/3.0_pReal*1.0e-6_pReal
write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> gdot', prm%dot_gamma_0 * (3.0_pReal*prm%M*stt%xi(of))**(-prm%n) & write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> gdot', prm%dot_gamma_0 * (3.0_pReal*prm%M*stt%xi(of))**(-prm%n) &
* tr * abs(tr)**(prm%n-1.0_pReal) * tr * abs(tr)**(prm%n-1.0_pReal)

14
src/constitutive_plastic_kinehardening.f90
View File

@ -74,11 +74,10 @@ module subroutine plastic_kinehardening_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
extmsg = '' extmsg = ''
write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_KINEHARDENING_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_KINEHARDENING_LABEL//' init -+>>>'
Ninstance = count(phase_plasticity == PLASTICITY_KINEHARDENING_ID) Ninstance = count(phase_plasticity == PLASTICITY_KINEHARDENING_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))
@ -96,8 +95,8 @@ module subroutine plastic_kinehardening_init
prm%output = config%getStrings('(output)',defaultVal=emptyStringArray) prm%output = config%getStrings('(output)',defaultVal=emptyStringArray)
#ifdef DEBUG #ifdef DEBUG
if (p==material_phaseAt(debug_g,debug_e)) then if (p==material_phaseAt(debugConstitutive%grain,debugConstitutive%element)) then
prm%of_debug = material_phasememberAt(debug_g,debug_i,debug_e) prm%of_debug = material_phasememberAt(debugConstitutive%grain,debugConstitutive%ip,debugConstitutive%element)
endif endif
#endif #endif
@ -328,9 +327,8 @@ module subroutine plastic_kinehardening_deltaState(Mp,instance,of)
dEq0(gdot_pos+gdot_neg,1e-10_pReal)) ! current sense of shear direction dEq0(gdot_pos+gdot_neg,1e-10_pReal)) ! current sense of shear direction
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive), debug_levelExtensive) /= 0 & if (debugConstitutive%extensive &
.and. (of == prm%of_debug & .and. (of == prm%of_debug .or. .not. debugConstitutive%selective)) then
.or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0)) then
write(6,'(a)') '======= kinehardening delta state =======' write(6,'(a)') '======= kinehardening delta state ======='
write(6,*) sense,state(instance)%sense(:,of) write(6,*) sense,state(instance)%sense(:,of)
endif endif

5
src/constitutive_plastic_none.f90
View File

@ -19,11 +19,10 @@ module subroutine plastic_none_init
p, & p, &
NipcMyPhase NipcMyPhase
write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_NONE_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_NONE_LABEL//' init -+>>>'
Ninstance = count(phase_plasticity == PLASTICITY_NONE_ID) Ninstance = count(phase_plasticity == PLASTICITY_NONE_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
do p = 1, size(phase_plasticity) do p = 1, size(phase_plasticity)
if (phase_plasticity(p) /= PLASTICITY_NONE_ID) cycle if (phase_plasticity(p) /= PLASTICITY_NONE_ID) cycle

29
src/constitutive_plastic_nonlocal.f90
View File

@ -147,7 +147,7 @@ submodule(constitutive) plastic_nonlocal
v_scr_neg v_scr_neg
end type tNonlocalState end type tNonlocalState
type(tNonlocalState), allocatable, dimension(:) :: & type(tNonlocalState), allocatable, dimension(:) :: &
deltaState, & deltaState, &
dotState, & dotState, &
state, & state, &
@ -179,7 +179,7 @@ module subroutine plastic_nonlocal_init
type(tInitialParameters) :: & type(tInitialParameters) :: &
ini ini
write(6,'(/,a)') ' <<<+- constitutive_'//PLASTICITY_NONLOCAL_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- constitutive_'//PLASTICITY_NONLOCAL_LABEL//' init -+>>>'
write(6,'(/,a)') ' Reuber et al., Acta Materialia 71:333–348, 2014' write(6,'(/,a)') ' Reuber et al., Acta Materialia 71:333–348, 2014'
write(6,'(a)') ' https://doi.org/10.1016/j.actamat.2014.03.012' write(6,'(a)') ' https://doi.org/10.1016/j.actamat.2014.03.012'
@ -188,8 +188,7 @@ module subroutine plastic_nonlocal_init
write(6,'(a)') ' http://publications.rwth-aachen.de/record/229993' write(6,'(a)') ' http://publications.rwth-aachen.de/record/229993'
Ninstance = count(phase_plasticity == PLASTICITY_NONLOCAL_ID) Ninstance = count(phase_plasticity == PLASTICITY_NONLOCAL_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))
@ -710,9 +709,9 @@ module subroutine plastic_nonlocal_dependentState(F, Fp, instance, of, ip, el)
endif endif
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive),debug_levelExtensive) /= 0 & if (debugConstitutive%extensive &
.and. ((debug_e == el .and. debug_i == ip)& .and. ((debugConstitutive%element == el .and. debugConstitutive%ip == ip)&
.or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0)) then .or. .not. debugConstitutive%selective)) then
write(6,'(/,a,i8,1x,i2,1x,i1,/)') '<< CONST >> nonlocal_microstructure at el ip ',el,ip write(6,'(/,a,i8,1x,i2,1x,i1,/)') '<< CONST >> nonlocal_microstructure at el ip ',el,ip
write(6,'(a,/,12x,12(e10.3,1x))') '<< CONST >> rhoForest', stt%rho_forest(:,of) write(6,'(a,/,12x,12(e10.3,1x))') '<< CONST >> rhoForest', stt%rho_forest(:,of)
write(6,'(a,/,12x,12(f10.5,1x))') '<< CONST >> tauThreshold / MPa', dst%tau_pass(:,of)*1e-6 write(6,'(a,/,12x,12(f10.5,1x))') '<< CONST >> tauThreshold / MPa', dst%tau_pass(:,of)*1e-6
@ -927,9 +926,9 @@ module subroutine plastic_nonlocal_deltaState(Mp,instance,of,ip,el)
del%rho(:,of) = reshape(deltaRhoRemobilization + deltaRhoDipole2SingleStress, [10*ns]) del%rho(:,of) = reshape(deltaRhoRemobilization + deltaRhoDipole2SingleStress, [10*ns])
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive),debug_levelExtensive) /= 0 & if (debugConstitutive%extensive &
.and. ((debug_e == el .and. debug_i == ip)& .and. ((debugConstitutive%element == el .and. debugConstitutive%ip == ip)&
.or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0 )) then .or. .not. debugConstitutive%selective)) then
write(6,'(a,/,8(12x,12(e12.5,1x),/))') '<< CONST >> dislocation remobilization', deltaRhoRemobilization(:,1:8) write(6,'(a,/,8(12x,12(e12.5,1x),/))') '<< CONST >> dislocation remobilization', deltaRhoRemobilization(:,1:8)
write(6,'(a,/,10(12x,12(e12.5,1x),/),/)') '<< CONST >> dipole dissociation by stress increase', deltaRhoDipole2SingleStress write(6,'(a,/,10(12x,12(e12.5,1x),/),/)') '<< CONST >> dipole dissociation by stress increase', deltaRhoDipole2SingleStress
endif endif
@ -1016,9 +1015,9 @@ module subroutine plastic_nonlocal_dotState(Mp, F, Fp, Temperature,timestep, &
gdot = rhoSgl(:,1:4) * v * spread(prm%burgers,2,4) gdot = rhoSgl(:,1:4) * v * spread(prm%burgers,2,4)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0 & if (debugConstitutive%basic &
.and. ((debug_e == el .and. debug_i == ip)& .and. ((debugConstitutive%element == el .and. debugConstitutive%ip == ip) &
.or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0 )) then .or. .not. debugConstitutive%selective)) then
write(6,'(a,/,10(12x,12(e12.5,1x),/))') '<< CONST >> rho / 1/m^2', rhoSgl, rhoDip write(6,'(a,/,10(12x,12(e12.5,1x),/))') '<< CONST >> rho / 1/m^2', rhoSgl, rhoDip
write(6,'(a,/,4(12x,12(e12.5,1x),/))') '<< CONST >> gdot / 1/s',gdot write(6,'(a,/,4(12x,12(e12.5,1x),/))') '<< CONST >> gdot / 1/s',gdot
endif endif
@ -1127,7 +1126,7 @@ module subroutine plastic_nonlocal_dotState(Mp, F, Fp, Temperature,timestep, &
if ( any(rho(:,mob) + rhoDot(:,1:4) * timestep < -prm%atol_rho) & if ( any(rho(:,mob) + rhoDot(:,1:4) * timestep < -prm%atol_rho) &
.or. any(rho(:,dip) + rhoDot(:,9:10) * timestep < -prm%atol_rho)) then .or. any(rho(:,dip) + rhoDot(:,9:10) * timestep < -prm%atol_rho)) then
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive),debug_levelExtensive) /= 0) then if (debugConstitutive%extensive) then
write(6,'(a,i5,a,i2)') '<< CONST >> evolution rate leads to negative density at el ',el,' ip ',ip write(6,'(a,i5,a,i2)') '<< CONST >> evolution rate leads to negative density at el ',el,' ip ',ip
write(6,'(a)') '<< CONST >> enforcing cutback !!!' write(6,'(a)') '<< CONST >> enforcing cutback !!!'
endif endif
@ -1239,7 +1238,7 @@ function rhoDotFlux(F,Fp,timestep, instance,of,ip,el)
.and. prm%CFLfactor * abs(v0) * timestep & .and. prm%CFLfactor * abs(v0) * timestep &
> IPvolume(ip,el) / maxval(IParea(:,ip,el)))) then ! ...with velocity above critical value (we use the reference volume and area for simplicity here) > IPvolume(ip,el) / maxval(IParea(:,ip,el)))) then ! ...with velocity above critical value (we use the reference volume and area for simplicity here)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_constitutive),debug_levelExtensive) /= 0) then if (debugConstitutive%extensive) then
write(6,'(a,i5,a,i2)') '<< CONST >> CFL condition not fullfilled at el ',el,' ip ',ip write(6,'(a,i5,a,i2)') '<< CONST >> CFL condition not fullfilled at el ',el,' ip ',ip
write(6,'(a,e10.3,a,e10.3)') '<< CONST >> velocity is at ', & write(6,'(a,e10.3,a,e10.3)') '<< CONST >> velocity is at ', &
maxval(abs(v0), abs(gdot) > 0.0_pReal & maxval(abs(v0), abs(gdot) > 0.0_pReal &

5
src/constitutive_plastic_phenopowerlaw.f90
View File

@ -83,11 +83,10 @@ module subroutine plastic_phenopowerlaw_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
extmsg = '' extmsg = ''
write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_PHENOPOWERLAW_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- plastic_'//PLASTICITY_PHENOPOWERLAW_LABEL//' init -+>>>'
Ninstance = count(phase_plasticity == PLASTICITY_PHENOPOWERLAW_ID) Ninstance = count(phase_plasticity == PLASTICITY_PHENOPOWERLAW_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))

58
src/crystallite.f90
View File

@ -23,7 +23,6 @@ module crystallite
use discretization use discretization
use lattice use lattice
use results use results
use YAML_types
implicit none implicit none
private private
@ -98,6 +97,19 @@ module crystallite
type(tNumerics) :: num ! numerics parameters. Better name? type(tNumerics) :: num ! numerics parameters. Better name?
type :: tDebugOptions
logical :: &
basic, &
extensive, &
selective
integer :: &
element, &
ip, &
grain
end type tDebugOptions
type(tDebugOptions) :: debugCrystallite
procedure(integrateStateFPI), pointer :: integrateState procedure(integrateStateFPI), pointer :: integrateState
public :: & public :: &
@ -130,9 +142,19 @@ subroutine crystallite_init
myNcomponents !< number of components at current IP myNcomponents !< number of components at current IP
class(tNode), pointer :: & class(tNode), pointer :: &
num_crystallite num_crystallite, &
debug_crystallite ! pointer to debug options for crystallite
write(6,'(/,a)') ' <<<+- crystallite init -+>>>' write(6,'(/,a)') ' <<<+- crystallite init -+>>>'
debug_crystallite => debug_root%get('crystallite', defaultVal=emptyList)
debugCrystallite%basic = debug_crystallite%contains('basic')
debugCrystallite%extensive = debug_crystallite%contains('extensive')
debugCrystallite%selective = debug_crystallite%contains('selective')
debugCrystallite%element = debug_root%get_asInt('element', defaultVal=1)
debugCrystallite%ip = debug_root%get_asInt('integrationpoint', defaultVal=1)
debugCrystallite%grain = debug_root%get_asInt('grain', defaultVal=1)
cMax = homogenization_maxNgrains cMax = homogenization_maxNgrains
iMax = discretization_nIP iMax = discretization_nIP
eMax = discretization_nElem eMax = discretization_nElem
@ -269,7 +291,7 @@ subroutine crystallite_init
call crystallite_stressTangent call crystallite_stressTangent
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_crystallite), debug_levelBasic) /= 0) then if (debugCrystallite%basic) then
write(6,'(a42,1x,i10)') ' # of elements: ', eMax write(6,'(a42,1x,i10)') ' # of elements: ', eMax
write(6,'(a42,1x,i10)') ' # of integration points/element: ', iMax write(6,'(a42,1x,i10)') ' # of integration points/element: ', iMax
write(6,'(a42,1x,i10)') 'max # of constituents/integration point: ', cMax write(6,'(a42,1x,i10)') 'max # of constituents/integration point: ', cMax
@ -297,26 +319,32 @@ function crystallite_stress()
startIP, endIP, & startIP, endIP, &
s s
logical, dimension(homogenization_maxNgrains,discretization_nIP,discretization_nElem) :: todo !ToDo: need to set some values to false for different Ngrains logical, dimension(homogenization_maxNgrains,discretization_nIP,discretization_nElem) :: todo !ToDo: need to set some values to false for different Ngrains
todo = .false. todo = .false.
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_crystallite),debug_levelSelective) /= 0 & if (debugCrystallite%selective &
.and. FEsolving_execElem(1) <= debug_e & .and. FEsolving_execElem(1) <= debugCrystallite%element &
.and. debug_e <= FEsolving_execElem(2)) then .and. debugCrystallite%element <= FEsolving_execElem(2)) then
write(6,'(/,a,i8,1x,i2,1x,i3)') '<< CRYST stress >> boundary and initial values at el ip ipc ', & write(6,'(/,a,i8,1x,i2,1x,i3)') '<< CRYST stress >> boundary and initial values at el ip ipc ', &
debug_e,debug_i, debug_g debugCrystallite%element,debugCrystallite%ip, debugCrystallite%grain
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> F ', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> F ', &
transpose(crystallite_partionedF(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedF(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> F0 ', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> F0 ', &
transpose(crystallite_partionedF0(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedF0(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Fp0', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Fp0', &
transpose(crystallite_partionedFp0(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedFp0(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Fi0', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Fi0', &
transpose(crystallite_partionedFi0(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedFi0(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Lp0', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Lp0', &
transpose(crystallite_partionedLp0(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedLp0(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Li0', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST stress >> Li0', &
transpose(crystallite_partionedLi0(1:3,1:3,debug_g,debug_i,debug_e)) transpose(crystallite_partionedLi0(1:3,1:3,debugCrystallite%grain, &
debugCrystallite%ip,debugCrystallite%element))
endif endif
#endif #endif
@ -362,7 +390,7 @@ function crystallite_stress()
NiterationCrystallite = NiterationCrystallite + 1 NiterationCrystallite = NiterationCrystallite + 1
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_crystallite),debug_levelExtensive) /= 0) & if (debugCrystallite%extensive) &
write(6,'(a,i6)') '<< CRYST stress >> crystallite iteration ',NiterationCrystallite write(6,'(a,i6)') '<< CRYST stress >> crystallite iteration ',NiterationCrystallite
#endif #endif
!$OMP PARALLEL DO PRIVATE(formerSubStep) !$OMP PARALLEL DO PRIVATE(formerSubStep)

192
src/debug.f90
View File

@ -8,51 +8,15 @@
module debug module debug
use prec use prec
use IO use IO
use YAML_types
use YAML_parse
implicit none implicit none
private private
integer, parameter, public :: & class(tNode), pointer, protected, public :: &
debug_LEVELSELECTIVE = 2**0, & debug_root !< root pointer storing the debug YAML structure
debug_LEVELBASIC = 2**1, &
debug_LEVELEXTENSIVE = 2**2
integer, parameter, private :: &
debug_MAXGENERAL = debug_LEVELEXTENSIVE ! must be set to the last bitcode used by (potentially) all debug types
integer, parameter, public :: &
debug_SPECTRALRESTART = debug_MAXGENERAL*2**1, &
debug_SPECTRALFFTW = debug_MAXGENERAL*2**2, &
debug_SPECTRALDIVERGENCE = debug_MAXGENERAL*2**3, &
debug_SPECTRALROTATION = debug_MAXGENERAL*2**4, &
debug_SPECTRALPETSC = debug_MAXGENERAL*2**5
integer, parameter, public :: &
debug_DEBUG = 1, &
debug_MATH = 2, &
debug_FESOLVING = 3, &
debug_MESH = 4, & !< stores debug level for mesh part of DAMASK bitwise coded
debug_MATERIAL = 5, & !< stores debug level for material part of DAMASK bitwise coded
debug_LATTICE = 6, & !< stores debug level for lattice part of DAMASK bitwise coded
debug_CONSTITUTIVE = 7, & !< stores debug level for constitutive part of DAMASK bitwise coded
debug_CRYSTALLITE = 8, &
debug_HOMOGENIZATION = 9, &
debug_CPFEM = 10, &
debug_SPECTRAL = 11, &
debug_MARC = 12
integer, parameter, private :: &
debug_MAXNTYPE = debug_MARC !< must be set to the maximum defined debug type
integer,protected, dimension(debug_maxNtype+2), public :: & ! specific ones, and 2 for "all" and "other"
debug_level = 0
integer, protected, public :: &
debug_e = 1, &
debug_i = 1, &
debug_g = 1
#ifdef PETSc
character(len=1024), parameter, public :: &
PETSCDEBUG = ' -snes_view -snes_monitor '
#endif
public :: debug_init public :: debug_init
contains contains
@ -63,11 +27,9 @@ contains
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
subroutine debug_init subroutine debug_init
character(len=pStringLen), dimension(:), allocatable :: fileContent character(len=:), allocatable :: &
debug_input, &
integer :: i, what, j debug_inFlow
integer, allocatable, dimension(:) :: chunkPos
character(len=pStringLen) :: tag, line
logical :: fexist logical :: fexist
write(6,'(/,a)') ' <<<+- debug init -+>>>' write(6,'(/,a)') ' <<<+- debug init -+>>>'
@ -75,144 +37,14 @@ subroutine debug_init
write(6,'(a)') achar(27)//'[31m <<<+- DEBUG version -+>>>'//achar(27)//'[0m' write(6,'(a)') achar(27)//'[31m <<<+- DEBUG version -+>>>'//achar(27)//'[0m'
#endif #endif
debug_root => emptyDict
inquire(file='debug.config', exist=fexist) inquire(file='debug.yaml', exist=fexist)
fileExists: if (fexist) then fileExists: if (fexist) then
fileContent = IO_read_ASCII('debug.config') debug_input = IO_read('debug.yaml')
do j=1, size(fileContent) debug_inFlow = to_flow(debug_input)
line = fileContent(j) debug_root => parse_flow(debug_inFlow)
if (IO_isBlank(line)) cycle ! skip empty lines
chunkPos = IO_stringPos(line)
tag = IO_lc(IO_stringValue(line,chunkPos,1)) ! extract key
select case(tag)
case ('element','e','el')
debug_e = IO_intValue(line,chunkPos,2)
case ('integrationpoint','i','ip')
debug_i = IO_intValue(line,chunkPos,2)
case ('grain','g','gr')
debug_g = IO_intValue(line,chunkPos,2)
end select
what = 0
select case(tag)
case ('debug')
what = debug_DEBUG
case ('math')
what = debug_MATH
case ('fesolving', 'fe')
what = debug_FESOLVING
case ('mesh')
what = debug_MESH
case ('material')
what = debug_MATERIAL
case ('lattice')
what = debug_LATTICE
case ('constitutive')
what = debug_CONSTITUTIVE
case ('crystallite')
what = debug_CRYSTALLITE
case ('homogenization')
what = debug_HOMOGENIZATION
case ('cpfem')
what = debug_CPFEM
case ('spectral')
what = debug_SPECTRAL
case ('marc')
what = debug_MARC
case ('all')
what = debug_MAXNTYPE + 1
case ('other')
what = debug_MAXNTYPE + 2
end select
if (what /= 0) then
do i = 2, chunkPos(1)
select case(IO_lc(IO_stringValue(line,chunkPos,i)))
case('basic')
debug_level(what) = ior(debug_level(what), debug_LEVELBASIC)
case('extensive')
debug_level(what) = ior(debug_level(what), debug_LEVELEXTENSIVE)
case('selective')
debug_level(what) = ior(debug_level(what), debug_LEVELSELECTIVE)
case('restart')
debug_level(what) = ior(debug_level(what), debug_SPECTRALRESTART)
case('fft','fftw')
debug_level(what) = ior(debug_level(what), debug_SPECTRALFFTW)
case('divergence')
debug_level(what) = ior(debug_level(what), debug_SPECTRALDIVERGENCE)
case('rotation')
debug_level(what) = ior(debug_level(what), debug_SPECTRALROTATION)
case('petsc')
debug_level(what) = ior(debug_level(what), debug_SPECTRALPETSC)
end select
enddo
endif
enddo
do i = 1, debug_maxNtype
if (debug_level(i) == 0) &
debug_level(i) = ior(debug_level(i), debug_level(debug_MAXNTYPE + 2)) ! fill undefined debug types with levels specified by "other"
debug_level(i) = ior(debug_level(i), debug_level(debug_MAXNTYPE + 1)) ! fill all debug types with levels specified by "all"
enddo
if (iand(debug_level(debug_debug),debug_LEVELBASIC) /= 0) &
write(6,'(a,/)') ' using values from config file'
else fileExists
if (iand(debug_level(debug_debug),debug_LEVELBASIC) /= 0) &
write(6,'(a,/)') ' using standard values'
endif fileExists endif fileExists
!--------------------------------------------------------------------------------------------------
! output switched on (debug level for debug must be extensive)
if (iand(debug_level(debug_debug),debug_LEVELEXTENSIVE) /= 0) then
do i = 1, debug_MAXNTYPE
select case(i)
case (debug_DEBUG)
tag = ' Debug'
case (debug_MATH)
tag = ' Math'
case (debug_FESOLVING)
tag = ' FEsolving'
case (debug_MESH)
tag = ' Mesh'
case (debug_MATERIAL)
tag = ' Material'
case (debug_LATTICE)
tag = ' Lattice'
case (debug_CONSTITUTIVE)
tag = ' Constitutive'
case (debug_CRYSTALLITE)
tag = ' Crystallite'
case (debug_HOMOGENIZATION)
tag = ' Homogenizaiton'
case (debug_CPFEM)
tag = ' CPFEM'
case (debug_SPECTRAL)
tag = ' Spectral solver'
case (debug_MARC)
tag = ' MSC.MARC FEM solver'
end select
if(debug_level(i) /= 0) then
write(6,'(3a)') ' debug level for ', trim(tag), ':'
if(iand(debug_level(i),debug_LEVELBASIC) /= 0) write(6,'(a)') ' basic'
if(iand(debug_level(i),debug_LEVELEXTENSIVE) /= 0) write(6,'(a)') ' extensive'
if(iand(debug_level(i),debug_LEVELSELECTIVE) /= 0) then
write(6,'(a)') ' selective on:'
write(6,'(a24,1x,i8)') ' element: ',debug_e
write(6,'(a24,1x,i8)') ' ip: ',debug_i
write(6,'(a24,1x,i8)') ' grain: ',debug_g
endif
if(iand(debug_level(i),debug_SPECTRALRESTART) /= 0) write(6,'(a)') ' restart'
if(iand(debug_level(i),debug_SPECTRALFFTW) /= 0) write(6,'(a)') ' FFTW'
if(iand(debug_level(i),debug_SPECTRALDIVERGENCE)/= 0) write(6,'(a)') ' divergence'
if(iand(debug_level(i),debug_SPECTRALROTATION) /= 0) write(6,'(a)') ' rotation'
if(iand(debug_level(i),debug_SPECTRALPETSC) /= 0) write(6,'(a)') ' PETSc'
endif
enddo
endif
end subroutine debug_init end subroutine debug_init
end module debug end module debug

11
src/grid/DAMASK_grid.f90
View File

@ -24,7 +24,6 @@ program DAMASK_grid
use grid_damage_spectral use grid_damage_spectral
use grid_thermal_spectral use grid_thermal_spectral
use results use results
use YAML_types
implicit none implicit none
@ -93,7 +92,8 @@ program DAMASK_grid
external :: & external :: &
quit quit
class (tNode), pointer :: & class (tNode), pointer :: &
num_grid num_grid, &
debug_grid ! pointer to grid debug options
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! init DAMASK (all modules) ! init DAMASK (all modules)
@ -124,6 +124,7 @@ program DAMASK_grid
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! assign mechanics solver depending on selected type ! assign mechanics solver depending on selected type
debug_grid => debug_root%get('grid',defaultVal=emptyList)
select case (trim(num_grid%get_asString('solver', defaultVal = 'Basic'))) select case (trim(num_grid%get_asString('solver', defaultVal = 'Basic')))
case ('Basic') case ('Basic')
mech_init => grid_mech_spectral_basic_init mech_init => grid_mech_spectral_basic_init
@ -133,7 +134,7 @@ program DAMASK_grid
mech_restartWrite => grid_mech_spectral_basic_restartWrite mech_restartWrite => grid_mech_spectral_basic_restartWrite
case ('Polarisation') case ('Polarisation')
if(iand(debug_level(debug_spectral),debug_levelBasic)/= 0) & if(debug_grid%contains('basic')) &
call IO_warning(42, ext_msg='debug Divergence') call IO_warning(42, ext_msg='debug Divergence')
mech_init => grid_mech_spectral_polarisation_init mech_init => grid_mech_spectral_polarisation_init
mech_forward => grid_mech_spectral_polarisation_forward mech_forward => grid_mech_spectral_polarisation_forward
@ -142,7 +143,7 @@ program DAMASK_grid
mech_restartWrite => grid_mech_spectral_polarisation_restartWrite mech_restartWrite => grid_mech_spectral_polarisation_restartWrite
case ('FEM') case ('FEM')
if(iand(debug_level(debug_spectral),debug_levelBasic)/= 0) & if(debug_grid%contains('basic')) &
call IO_warning(42, ext_msg='debug Divergence') call IO_warning(42, ext_msg='debug Divergence')
mech_init => grid_mech_FEM_init mech_init => grid_mech_FEM_init
mech_forward => grid_mech_FEM_forward mech_forward => grid_mech_FEM_forward
@ -340,7 +341,7 @@ program DAMASK_grid
writeHeader: if (interface_restartInc < 1) then writeHeader: if (interface_restartInc < 1) then
open(newunit=statUnit,file=trim(getSolverJobName())//'.sta',form='FORMATTED',status='REPLACE') open(newunit=statUnit,file=trim(getSolverJobName())//'.sta',form='FORMATTED',status='REPLACE')
write(statUnit,'(a)') 'Increment Time CutbackLevel Converged IterationsNeeded' ! statistics file write(statUnit,'(a)') 'Increment Time CutbackLevel Converged IterationsNeeded' ! statistics file
if (iand(debug_level(debug_spectral),debug_levelBasic) /= 0) & if (debug_grid%contains('basic')) &
write(6,'(/,a)') ' header of statistics file written out' write(6,'(/,a)') ' header of statistics file written out'
flush(6) flush(6)
else writeHeader else writeHeader

14
src/grid/discretization_grid.f90
View File

@ -57,7 +57,10 @@ subroutine discretization_grid_init(restart)
microstructureAt, & microstructureAt, &
homogenizationAt homogenizationAt
integer :: j integer :: &
j, &
debug_element, &
debug_ip
integer(C_INTPTR_T) :: & integer(C_INTPTR_T) :: &
devNull, z, z_offset devNull, z, z_offset
@ -83,6 +86,11 @@ subroutine discretization_grid_init(restart)
myGrid = [grid(1:2),grid3] myGrid = [grid(1:2),grid3]
mySize = [geomSize(1:2),size3] mySize = [geomSize(1:2),size3]
!-------------------------------------------------------------------------------------------------
! debug parameters
debug_element = debug_root%get_asInt('element',defaultVal=1)
debug_ip = debug_root%get_asInt('integrationpoint',defaultVal=1)
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! general discretization ! general discretization
microstructureAt = microstructureAt(product(grid(1:2))*grid3Offset+1: & microstructureAt = microstructureAt(product(grid(1:2))*grid3Offset+1: &
@ -120,8 +128,8 @@ subroutine discretization_grid_init(restart)
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! sanity checks for debugging ! sanity checks for debugging
if (debug_e < 1 .or. debug_e > product(myGrid)) call IO_error(602,ext_msg='element') ! selected element does not exist if (debug_element < 1 .or. debug_element > product(myGrid)) call IO_error(602,ext_msg='element') ! selected element does not exist
if (debug_i /= 1) call IO_error(602,ext_msg='IP') ! selected IP does not exist if (debug_ip /= 1) call IO_error(602,ext_msg='IP') ! selected IP does not exist
end subroutine discretization_grid_init end subroutine discretization_grid_init

13
src/grid/grid_mech_FEM.f90
View File

@ -16,7 +16,6 @@ module grid_mech_FEM
use math use math
use spectral_utilities use spectral_utilities
use FEsolving use FEsolving
use YAML_types
use numerics use numerics
use homogenization use homogenization
use discretization use discretization
@ -45,6 +44,8 @@ module grid_mech_FEM
end type tNumerics end type tNumerics
type(tNumerics), private :: num type(tNumerics), private :: num
logical, private:: &
debugRotation
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! PETSc data ! PETSc data
@ -115,13 +116,19 @@ subroutine grid_mech_FEM_init
character(len=pStringLen) :: & character(len=pStringLen) :: &
fileName fileName
class(tNode), pointer :: & class(tNode), pointer :: &
num_grid num_grid, &
debug_grid
real(pReal), dimension(3,3,3,3) :: devNull real(pReal), dimension(3,3,3,3) :: devNull
PetscScalar, pointer, dimension(:,:,:,:) :: & PetscScalar, pointer, dimension(:,:,:,:) :: &
u_current,u_lastInc u_current,u_lastInc
write(6,'(/,a)') ' <<<+- grid_mech_FEM init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- grid_mech_FEM init -+>>>'; flush(6)
!-----------------------------------------------------------------------------------------------
! debugging options
debug_grid => debug_root%get('grid', defaultVal=emptyList)
debugRotation = debug_grid%contains('rotation')
!------------------------------------------------------------------------------------------------- !-------------------------------------------------------------------------------------------------
! read numerical parameter and do sanity checks ! read numerical parameter and do sanity checks
num_grid => numerics_root%get('grid',defaultVal=emptyDict) num_grid => numerics_root%get('grid',defaultVal=emptyDict)
@ -510,7 +517,7 @@ subroutine formResidual(da_local,x_local, &
newIteration: if (totalIter <= PETScIter) then newIteration: if (totalIter <= PETScIter) then
totalIter = totalIter + 1 totalIter = totalIter + 1
write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter+1, '≤', num%itmax write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter+1, '≤', num%itmax
if (iand(debug_level(debug_spectral),debug_spectralRotation) /= 0) & if (debugRotation) &
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &
' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.)) ' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.))
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &

14
src/grid/grid_mech_spectral_basic.f90
View File

@ -21,7 +21,6 @@ module grid_mech_spectral_basic
use homogenization use homogenization
use discretization_grid use discretization_grid
use debug use debug
use YAML_types
implicit none implicit none
private private
@ -44,6 +43,9 @@ module grid_mech_spectral_basic
type(tNumerics) :: num ! numerics parameters. Better name? type(tNumerics) :: num ! numerics parameters. Better name?
logical, private:: &
debugRotation
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! PETSc data ! PETSc data
DM :: da DM :: da
@ -97,7 +99,8 @@ subroutine grid_mech_spectral_basic_init
real(pReal), dimension(3,3) :: & real(pReal), dimension(3,3) :: &
temp33_Real = 0.0_pReal temp33_Real = 0.0_pReal
class (tNode), pointer :: & class (tNode), pointer :: &
num_grid num_grid, &
debug_grid
PetscErrorCode :: ierr PetscErrorCode :: ierr
PetscScalar, pointer, dimension(:,:,:,:) :: & PetscScalar, pointer, dimension(:,:,:,:) :: &
@ -116,6 +119,11 @@ subroutine grid_mech_spectral_basic_init
write(6,'(/,a)') ' Shanthraj et al., International Journal of Plasticity 66:31–45, 2015' write(6,'(/,a)') ' Shanthraj et al., International Journal of Plasticity 66:31–45, 2015'
write(6,'(a)') ' https://doi.org/10.1016/j.ijplas.2014.02.006' write(6,'(a)') ' https://doi.org/10.1016/j.ijplas.2014.02.006'
!-------------------------------------------------------------------------------------------------
! debugging options
debug_grid => debug_root%get('grid', defaultVal=emptyList)
debugRotation = debug_grid%contains('rotation')
!------------------------------------------------------------------------------------------------- !-------------------------------------------------------------------------------------------------
! read numerical parameters and do sanity checks ! read numerical parameters and do sanity checks
num_grid => numerics_root%get('grid',defaultVal=emptyDict) num_grid => numerics_root%get('grid',defaultVal=emptyDict)
@ -469,7 +477,7 @@ subroutine formResidual(in, F, &
newIteration: if (totalIter <= PETScIter) then newIteration: if (totalIter <= PETScIter) then
totalIter = totalIter + 1 totalIter = totalIter + 1
write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter, '≤', num%itmax write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter, '≤', num%itmax
if (iand(debug_level(debug_spectral),debug_spectralRotation) /= 0) & if (debugRotation) &
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &
' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.)) ' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.))
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &

14
src/grid/grid_mech_spectral_polarisation.f90
View File

@ -22,7 +22,6 @@ module grid_mech_spectral_polarisation
use homogenization use homogenization
use discretization_grid use discretization_grid
use debug use debug
use YAML_types
implicit none implicit none
private private
@ -50,6 +49,8 @@ module grid_mech_spectral_polarisation
type(tNumerics) :: num ! numerics parameters. Better name? type(tNumerics) :: num ! numerics parameters. Better name?
logical, private :: debugRotation
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! PETSc data ! PETSc data
DM :: da DM :: da
@ -109,7 +110,8 @@ subroutine grid_mech_spectral_polarisation_init
real(pReal), dimension(3,3) :: & real(pReal), dimension(3,3) :: &
temp33_Real = 0.0_pReal temp33_Real = 0.0_pReal
class (tNode), pointer :: & class (tNode), pointer :: &
num_grid num_grid, &
debug_grid
PetscErrorCode :: ierr PetscErrorCode :: ierr
PetscScalar, pointer, dimension(:,:,:,:) :: & PetscScalar, pointer, dimension(:,:,:,:) :: &
@ -127,6 +129,11 @@ subroutine grid_mech_spectral_polarisation_init
write(6,'(/,a)') ' Shanthraj et al., International Journal of Plasticity 66:31–45, 2015' write(6,'(/,a)') ' Shanthraj et al., International Journal of Plasticity 66:31–45, 2015'
write(6,'(a)') ' https://doi.org/10.1016/j.ijplas.2014.02.006' write(6,'(a)') ' https://doi.org/10.1016/j.ijplas.2014.02.006'
!------------------------------------------------------------------------------------------------
! debugging options
debug_grid => debug_root%get('grid',defaultVal=emptyList)
debugRotation = debug_grid%contains('rotation')
!------------------------------------------------------------------------------------------------- !-------------------------------------------------------------------------------------------------
! read numerical parameters ! read numerical parameters
num_grid => numerics_root%get('grid',defaultVal=emptyDict) num_grid => numerics_root%get('grid',defaultVal=emptyDict)
@ -547,12 +554,13 @@ subroutine formResidual(in, FandF_tau, &
call SNESGetIterationNumber(snes,PETScIter,ierr); CHKERRQ(ierr) call SNESGetIterationNumber(snes,PETScIter,ierr); CHKERRQ(ierr)
if (nfuncs == 0 .and. PETScIter == 0) totalIter = -1 ! new increment if (nfuncs == 0 .and. PETScIter == 0) totalIter = -1 ! new increment
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! begin of new iteration ! begin of new iteration
newIteration: if (totalIter <= PETScIter) then newIteration: if (totalIter <= PETScIter) then
totalIter = totalIter + 1 totalIter = totalIter + 1
write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter, '≤', num%itmax write(6,'(1x,a,3(a,i0))') trim(incInfo), ' @ Iteration ', num%itmin, '≤',totalIter, '≤', num%itmax
if (iand(debug_level(debug_spectral),debug_spectralRotation) /= 0) & if(debugRotation) &
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &
' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.)) ' deformation gradient aim (lab) =', transpose(params%rotation_BC%rotate(F_aim,active=.true.))
write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') & write(6,'(/,a,/,3(3(f12.7,1x)/))',advance='no') &

16
src/grid/spectral_utilities.f90
View File

@ -19,7 +19,6 @@ module spectral_utilities
use config use config
use discretization use discretization
use homogenization use homogenization
use YAML_types
implicit none implicit none
private private
@ -188,8 +187,11 @@ subroutine spectral_utilities_init
scalarSize = 1_C_INTPTR_T, & scalarSize = 1_C_INTPTR_T, &
vecSize = 3_C_INTPTR_T, & vecSize = 3_C_INTPTR_T, &
tensorSize = 9_C_INTPTR_T tensorSize = 9_C_INTPTR_T
class(tNode), pointer :: & character(len=*), parameter :: &
num_grid PETSCDEBUG = ' -snes_view -snes_monitor '
class(tNode) , pointer :: &
num_grid, &
debug_grid ! pointer to grid debug options
write(6,'(/,a)') ' <<<+- spectral_utilities init -+>>>' write(6,'(/,a)') ' <<<+- spectral_utilities init -+>>>'
@ -207,9 +209,11 @@ subroutine spectral_utilities_init
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! set debugging parameters ! set debugging parameters
debugGeneral = iand(debug_level(debug_SPECTRAL),debug_LEVELBASIC) /= 0 debug_grid => debug_root%get('grid',defaultVal=emptyList)
debugRotation = iand(debug_level(debug_SPECTRAL),debug_SPECTRALROTATION) /= 0 debugGeneral = debug_grid%contains('basic')
debugPETSc = iand(debug_level(debug_SPECTRAL),debug_SPECTRALPETSC) /= 0 debugRotation = debug_grid%contains('rotation')
debugPETSc = debug_grid%contains('petsc')
if(debugPETSc) write(6,'(3(/,a),/)') & if(debugPETSc) write(6,'(3(/,a),/)') &
' Initializing PETSc with debug options: ', & ' Initializing PETSc with debug options: ', &

67
src/homogenization.f90
View File

@ -23,7 +23,6 @@ module homogenization
use damage_local use damage_local
use damage_nonlocal use damage_nonlocal
use results use results
use YAML_types
implicit none implicit none
private private
@ -52,6 +51,19 @@ module homogenization
type(tNumerics) :: num type(tNumerics) :: num
type :: tDebugOptions
logical :: &
basic, &
extensive, &
selective
integer :: &
element, &
ip, &
grain
end type tDebugOptions
type(tDebugOptions) :: debugHomog
interface interface
module subroutine mech_none_init module subroutine mech_none_init
@ -98,19 +110,18 @@ module homogenization
integer, intent(in) :: instance integer, intent(in) :: instance
end subroutine mech_RGC_averageStressAndItsTangent end subroutine mech_RGC_averageStressAndItsTangent
module function mech_RGC_updateState(P,F,F0,avgF,dt,dPdF,ip,el) module function mech_RGC_updateState(P,F,F0,avgF,dt,dPdF,ip,el)
logical, dimension(2) :: mech_RGC_updateState logical, dimension(2) :: mech_RGC_updateState
real(pReal), dimension(:,:,:), intent(in) :: & real(pReal), dimension(:,:,:), intent(in) :: &
P,& !< partitioned stresses P,& !< partitioned stresses
F,& !< partitioned deformation gradients F,& !< partitioned deformation gradients
F0 !< partitioned initial deformation gradients F0 !< partitioned initial deformation gradients
real(pReal), dimension(:,:,:,:,:), intent(in) :: dPdF !< partitioned stiffnesses real(pReal), dimension(:,:,:,:,:), intent(in) :: dPdF !< partitioned stiffnesses
real(pReal), dimension(3,3), intent(in) :: avgF !< average F real(pReal), dimension(3,3), intent(in) :: avgF !< average F
real(pReal), intent(in) :: dt !< time increment real(pReal), intent(in) :: dt !< time increment
integer, intent(in) :: & integer, intent(in) :: &
ip, & !< integration point number ip, & !< integration point number
el !< element number el !< element number
end function mech_RGC_updateState end function mech_RGC_updateState
@ -137,7 +148,21 @@ subroutine homogenization_init
class (tNode) , pointer :: & class (tNode) , pointer :: &
num_homog, & num_homog, &
num_homogMech, & num_homogMech, &
num_homogGeneric num_homogGeneric, &
debug_homogenization
debug_homogenization => debug_root%get('homogenization', defaultVal=emptyList)
debugHomog%basic = debug_homogenization%contains('basic')
debugHomog%extensive = debug_homogenization%contains('extensive')
debugHomog%selective = debug_homogenization%contains('selective')
debugHomog%element = debug_root%get_asInt('element',defaultVal = 1)
debugHomog%ip = debug_root%get_asInt('integrationpoint',defaultVal = 1)
debugHomog%grain = debug_root%get_asInt('grain',defaultVal = 1)
if (debugHomog%grain < 1 &
.or. debugHomog%grain > homogenization_Ngrains(material_homogenizationAt(debugHomog%element))) &
call IO_error(602,ext_msg='constituent', el=debugHomog%element, g=debugHomog%grain)
num_homog => numerics_root%get('homogenization',defaultVal=emptyDict) num_homog => numerics_root%get('homogenization',defaultVal=emptyDict)
num_homogMech => num_homog%get('mech',defaultVal=emptyDict) num_homogMech => num_homog%get('mech',defaultVal=emptyDict)
@ -166,9 +191,6 @@ subroutine homogenization_init
write(6,'(/,a)') ' <<<+- homogenization init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- homogenization init -+>>>'; flush(6)
if (debug_g < 1 .or. debug_g > homogenization_Ngrains(material_homogenizationAt(debug_e))) &
call IO_error(602,ext_msg='constituent', el=debug_e, g=debug_g)
num%nMPstate = num_homogGeneric%get_asInt ('nMPstate', defaultVal=10) num%nMPstate = num_homogGeneric%get_asInt ('nMPstate', defaultVal=10)
num%subStepMinHomog = num_homogGeneric%get_asFloat('subStepMin', defaultVal=1.0e-3_pReal) num%subStepMinHomog = num_homogGeneric%get_asFloat('subStepMin', defaultVal=1.0e-3_pReal)
num%subStepSizeHomog = num_homogGeneric%get_asFloat('subStepSize', defaultVal=0.25_pReal) num%subStepSizeHomog = num_homogGeneric%get_asFloat('subStepSize', defaultVal=0.25_pReal)
@ -207,13 +229,14 @@ subroutine materialpoint_stressAndItsTangent(updateJaco,dt)
doneAndHappy doneAndHappy
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelBasic) /= 0) then
write(6,'(/a,i5,1x,i2)') '<< HOMOG >> Material Point start at el ip ', debug_e, debug_i if (debugHomog%basic) then
write(6,'(/a,i5,1x,i2)') '<< HOMOG >> Material Point start at el ip ', debugHomog%element, debugHomog%ip
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< HOMOG >> F0', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< HOMOG >> F0', &
transpose(materialpoint_F0(1:3,1:3,debug_i,debug_e)) transpose(materialpoint_F0(1:3,1:3,debugHomog%ip,debugHomog%element))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< HOMOG >> F', & write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< HOMOG >> F', &
transpose(materialpoint_F(1:3,1:3,debug_i,debug_e)) transpose(materialpoint_F(1:3,1:3,debugHomog%ip,debugHomog%element))
endif endif
#endif #endif
@ -272,9 +295,9 @@ subroutine materialpoint_stressAndItsTangent(updateJaco,dt)
if (converged(i,e)) then if (converged(i,e)) then
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0 & if (debugHomog%extensive &
.and. ((e == debug_e .and. i == debug_i) & .and. ((e == debugHomog%element .and. i == debugHomog%ip) &
.or. .not. iand(debug_level(debug_homogenization),debug_levelSelective) /= 0)) then .or. .not. debugHomog%selective)) then
write(6,'(a,1x,f12.8,1x,a,1x,f12.8,1x,a,i8,1x,i2/)') '<< HOMOG >> winding forward from', & write(6,'(a,1x,f12.8,1x,a,1x,f12.8,1x,a,i8,1x,i2/)') '<< HOMOG >> winding forward from', &
subFrac(i,e), 'to current subFrac', & subFrac(i,e), 'to current subFrac', &
subFrac(i,e)+subStep(i,e),'in materialpoint_stressAndItsTangent at el ip',e,i subFrac(i,e)+subStep(i,e),'in materialpoint_stressAndItsTangent at el ip',e,i
@ -331,9 +354,9 @@ subroutine materialpoint_stressAndItsTangent(updateJaco,dt)
subStep(i,e) = num%subStepSizeHomog * subStep(i,e) ! crystallite had severe trouble, so do a significant cutback subStep(i,e) = num%subStepSizeHomog * subStep(i,e) ! crystallite had severe trouble, so do a significant cutback
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0 & if (debugHomog%extensive &
.and. ((e == debug_e .and. i == debug_i) & .and. ((e == debugHomog%element .and. i == debugHomog%ip) &
.or. .not. iand(debug_level(debug_homogenization), debug_levelSelective) /= 0)) then .or. .not. debugHomog%selective)) then
write(6,'(a,1x,f12.8,a,i8,1x,i2/)') & write(6,'(a,1x,f12.8,a,i8,1x,i2/)') &
'<< HOMOG >> cutback step in materialpoint_stressAndItsTangent with new subStep:',& '<< HOMOG >> cutback step in materialpoint_stressAndItsTangent with new subStep:',&
subStep(i,e),' at el ip',e,i subStep(i,e),' at el ip',e,i

43
src/homogenization_mech_RGC.f90
View File

@ -89,7 +89,7 @@ module subroutine mech_RGC_init(num_homogMech)
class (tNode), pointer :: & class (tNode), pointer :: &
num_RGC ! pointer to RGC numerics data num_RGC ! pointer to RGC numerics data
write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_RGC_label//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_RGC_label//' init -+>>>'
write(6,'(/,a)') ' Tjahjanto et al., International Journal of Material Forming 2(1):939–942, 2009' write(6,'(/,a)') ' Tjahjanto et al., International Journal of Material Forming 2(1):939–942, 2009'
write(6,'(a)') ' https://doi.org/10.1007/s12289-009-0619-1' write(6,'(a)') ' https://doi.org/10.1007/s12289-009-0619-1'
@ -98,8 +98,7 @@ module subroutine mech_RGC_init(num_homogMech)
write(6,'(a)') ' https://doi.org/10.1088/0965-0393/18/1/015006' write(6,'(a)') ' https://doi.org/10.1088/0965-0393/18/1/015006'
Ninstance = count(homogenization_type == HOMOGENIZATION_RGC_ID) Ninstance = count(homogenization_type == HOMOGENIZATION_RGC_ID)
if (iand(debug_level(debug_HOMOGENIZATION),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) allocate(param(Ninstance))
allocate(state(Ninstance)) allocate(state(Ninstance))
@ -145,8 +144,8 @@ module subroutine mech_RGC_init(num_homogMech)
config => config_homogenization(h)) config => config_homogenization(h))
#ifdef DEBUG #ifdef DEBUG
if (h==material_homogenizationAt(debug_e)) then if (h==material_homogenizationAt(debugHomog%element)) then
prm%of_debug = material_homogenizationMemberAt(debug_i,debug_e) prm%of_debug = material_homogenizationMemberAt(debugHomog%ip,debugHomog%element)
endif endif
#endif #endif
@ -230,7 +229,7 @@ module subroutine mech_RGC_partitionDeformation(F,avgF,instance,of)
F(1:3,1:3,iGrain) = F(1:3,1:3,iGrain) + avgF ! resulting relaxed deformation gradient F(1:3,1:3,iGrain) = F(1:3,1:3,iGrain) + avgF ! resulting relaxed deformation gradient
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a32,1x,i3)')'Deformation gradient of grain: ',iGrain write(6,'(1x,a32,1x,i3)')'Deformation gradient of grain: ',iGrain
do i = 1,3 do i = 1,3
write(6,'(1x,3(e15.8,1x))')(F(i,j,iGrain), j = 1,3) write(6,'(1x,3(e15.8,1x))')(F(i,j,iGrain), j = 1,3)
@ -293,7 +292,7 @@ module procedure mech_RGC_updateState
drelax = stt%relaxationVector(:,of) - st0%relaxationVector(:,of) drelax = stt%relaxationVector(:,of) - st0%relaxationVector(:,of)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Obtained state: ' write(6,'(1x,a30)')'Obtained state: '
do i = 1,size(stt%relaxationVector(:,of)) do i = 1,size(stt%relaxationVector(:,of))
write(6,'(1x,2(e15.8,1x))') stt%relaxationVector(i,of) write(6,'(1x,2(e15.8,1x))') stt%relaxationVector(i,of)
@ -311,7 +310,7 @@ module procedure mech_RGC_updateState
call volumePenalty(D,dst%volumeDiscrepancy(of),avgF,F,nGrain,instance,of) call volumePenalty(D,dst%volumeDiscrepancy(of),avgF,F,nGrain,instance,of)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
do iGrain = 1,nGrain do iGrain = 1,nGrain
write(6,'(1x,a30,1x,i3,1x,a4,3(1x,e15.8))')'Mismatch magnitude of grain(',iGrain,') :',& write(6,'(1x,a30,1x,i3,1x,a4,3(1x,e15.8))')'Mismatch magnitude of grain(',iGrain,') :',&
NN(1,iGrain),NN(2,iGrain),NN(3,iGrain) NN(1,iGrain),NN(2,iGrain),NN(3,iGrain)
@ -359,7 +358,7 @@ module procedure mech_RGC_updateState
enddo enddo
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30,1x,i3)')'Traction at interface: ',iNum write(6,'(1x,a30,1x,i3)')'Traction at interface: ',iNum
write(6,'(1x,3(e15.8,1x))')(tract(iNum,j), j = 1,3) write(6,'(1x,3(e15.8,1x))')(tract(iNum,j), j = 1,3)
write(6,*)' ' write(6,*)' '
@ -373,7 +372,7 @@ module procedure mech_RGC_updateState
residMax = maxval(abs(tract)) ! get the maximum of the residual residMax = maxval(abs(tract)) ! get the maximum of the residual
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of) then if (debugHomog%extensive .and. prm%of_debug == of) then
stresLoc = maxloc(abs(P)) stresLoc = maxloc(abs(P))
residLoc = maxloc(abs(tract)) residLoc = maxloc(abs(tract))
write(6,'(1x,a)')' ' write(6,'(1x,a)')' '
@ -393,7 +392,7 @@ module procedure mech_RGC_updateState
if (residMax < num%rtol*stresMax .or. residMax < num%atol) then if (residMax < num%rtol*stresMax .or. residMax < num%atol) then
mech_RGC_updateState = .true. mech_RGC_updateState = .true.
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of) & if (debugHomog%extensive .and. prm%of_debug == of) &
write(6,'(1x,a55,/)')'... done and happy'; flush(6) write(6,'(1x,a55,/)')'... done and happy'; flush(6)
#endif #endif
@ -413,7 +412,7 @@ module procedure mech_RGC_updateState
dst%relaxationRate_max(of) = maxval(abs(drelax))/dt dst%relaxationRate_max(of) = maxval(abs(drelax))/dt
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of) then if (debugHomog%extensive .and. prm%of_debug == of) then
write(6,'(1x,a30,1x,e15.8)') 'Constitutive work: ',stt%work(of) write(6,'(1x,a30,1x,e15.8)') 'Constitutive work: ',stt%work(of)
write(6,'(1x,a30,3(1x,e15.8))')'Magnitude mismatch: ',dst%mismatch(1,of), & write(6,'(1x,a30,3(1x,e15.8))')'Magnitude mismatch: ',dst%mismatch(1,of), &
dst%mismatch(2,of), & dst%mismatch(2,of), &
@ -434,7 +433,7 @@ module procedure mech_RGC_updateState
mech_RGC_updateState = [.true.,.false.] ! with direct cut-back mech_RGC_updateState = [.true.,.false.] ! with direct cut-back
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of) & if (debugHomog%extensive .and. prm%of_debug == of) &
write(6,'(1x,a,/)') '... broken'; flush(6) write(6,'(1x,a,/)') '... broken'; flush(6)
#endif #endif
@ -442,7 +441,7 @@ module procedure mech_RGC_updateState
else ! proceed with computing the Jacobian and state update else ! proceed with computing the Jacobian and state update
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of) & if (debugHomog%extensive .and. prm%of_debug == of) &
write(6,'(1x,a,/)') '... not yet done'; flush(6) write(6,'(1x,a,/)') '... not yet done'; flush(6)
#endif #endif
@ -499,7 +498,7 @@ module procedure mech_RGC_updateState
enddo enddo
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Jacobian matrix of stress' write(6,'(1x,a30)')'Jacobian matrix of stress'
do i = 1,3*nIntFaceTot do i = 1,3*nIntFaceTot
write(6,'(1x,100(e11.4,1x))')(smatrix(i,j), j = 1,3*nIntFaceTot) write(6,'(1x,100(e11.4,1x))')(smatrix(i,j), j = 1,3*nIntFaceTot)
@ -559,7 +558,7 @@ module procedure mech_RGC_updateState
enddo enddo
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Jacobian matrix of penalty' write(6,'(1x,a30)')'Jacobian matrix of penalty'
do i = 1,3*nIntFaceTot do i = 1,3*nIntFaceTot
write(6,'(1x,100(e11.4,1x))')(pmatrix(i,j), j = 1,3*nIntFaceTot) write(6,'(1x,100(e11.4,1x))')(pmatrix(i,j), j = 1,3*nIntFaceTot)
@ -578,7 +577,7 @@ module procedure mech_RGC_updateState
enddo enddo
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Jacobian matrix of penalty' write(6,'(1x,a30)')'Jacobian matrix of penalty'
do i = 1,3*nIntFaceTot do i = 1,3*nIntFaceTot
write(6,'(1x,100(e11.4,1x))')(rmatrix(i,j), j = 1,3*nIntFaceTot) write(6,'(1x,100(e11.4,1x))')(rmatrix(i,j), j = 1,3*nIntFaceTot)
@ -593,7 +592,7 @@ module procedure mech_RGC_updateState
allocate(jmatrix(3*nIntFaceTot,3*nIntFaceTot)); jmatrix = smatrix + pmatrix + rmatrix allocate(jmatrix(3*nIntFaceTot,3*nIntFaceTot)); jmatrix = smatrix + pmatrix + rmatrix
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Jacobian matrix (total)' write(6,'(1x,a30)')'Jacobian matrix (total)'
do i = 1,3*nIntFaceTot do i = 1,3*nIntFaceTot
write(6,'(1x,100(e11.4,1x))')(jmatrix(i,j), j = 1,3*nIntFaceTot) write(6,'(1x,100(e11.4,1x))')(jmatrix(i,j), j = 1,3*nIntFaceTot)
@ -609,7 +608,7 @@ module procedure mech_RGC_updateState
call math_invert(jnverse,error,jmatrix) call math_invert(jnverse,error,jmatrix)
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization), debug_levelExtensive) /= 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Jacobian inverse' write(6,'(1x,a30)')'Jacobian inverse'
do i = 1,3*nIntFaceTot do i = 1,3*nIntFaceTot
write(6,'(1x,100(e11.4,1x))')(jnverse(i,j), j = 1,3*nIntFaceTot) write(6,'(1x,100(e11.4,1x))')(jnverse(i,j), j = 1,3*nIntFaceTot)
@ -636,7 +635,7 @@ module procedure mech_RGC_updateState
endif endif
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_homogenization, debug_levelExtensive) > 0) then if (debugHomog%extensive) then
write(6,'(1x,a30)')'Returned state: ' write(6,'(1x,a30)')'Returned state: '
do i = 1,size(stt%relaxationVector(:,of)) do i = 1,size(stt%relaxationVector(:,of))
write(6,'(1x,2(e15.8,1x))') stt%relaxationVector(i,of) write(6,'(1x,2(e15.8,1x))') stt%relaxationVector(i,of)
@ -686,7 +685,7 @@ module procedure mech_RGC_updateState
associate(prm => param(instance)) associate(prm => param(instance))
#ifdef DEBUG #ifdef DEBUG
debugActive = iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 .and. prm%of_debug == of debugActive = debugHomog%extensive .and. prm%of_debug == of
if (debugActive) then if (debugActive) then
write(6,'(1x,a20,2(1x,i3))')'Correction factor: ',ip,el write(6,'(1x,a20,2(1x,i3))')'Correction factor: ',ip,el
@ -796,7 +795,7 @@ module procedure mech_RGC_updateState
gVol(i)*transpose(math_inv33(fDef(:,:,i))) gVol(i)*transpose(math_inv33(fDef(:,:,i)))
#ifdef DEBUG #ifdef DEBUG
if (iand(debug_level(debug_homogenization),debug_levelExtensive) /= 0 & if (debugHomog%extensive &
.and. param(instance)%of_debug == of) then .and. param(instance)%of_debug == of) then
write(6,'(1x,a30,i2)')'Volume penalty of grain: ',i write(6,'(1x,a30,i2)')'Volume penalty of grain: ',i
write(6,*) transpose(vPen(:,:,i)) write(6,*) transpose(vPen(:,:,i))

3
src/homogenization_mech_isostrain.f90
View File

@ -38,8 +38,7 @@ module subroutine mech_isostrain_init
write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_ISOSTRAIN_LABEL//' init -+>>>' write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_ISOSTRAIN_LABEL//' init -+>>>'
Ninstance = count(homogenization_type == HOMOGENIZATION_ISOSTRAIN_ID) Ninstance = count(homogenization_type == HOMOGENIZATION_ISOSTRAIN_ID)
if (iand(debug_level(debug_HOMOGENIZATION),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(param(Ninstance)) ! one container of parameters per instance allocate(param(Ninstance)) ! one container of parameters per instance

5
src/homogenization_mech_none.f90
View File

@ -18,11 +18,10 @@ module subroutine mech_none_init
h, & h, &
NofMyHomog NofMyHomog
write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_NONE_label//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- homogenization_'//HOMOGENIZATION_NONE_label//' init -+>>>'
Ninstance = count(homogenization_type == HOMOGENIZATION_NONE_ID) Ninstance = count(homogenization_type == HOMOGENIZATION_NONE_ID)
if (iand(debug_level(debug_HOMOGENIZATION),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
do h = 1, size(homogenization_type) do h = 1, size(homogenization_type)
if (homogenization_type(h) /= HOMOGENIZATION_NONE_ID) cycle if (homogenization_type(h) /= HOMOGENIZATION_NONE_ID) cycle

6
src/kinematics_cleavage_opening.f90
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@ -8,7 +8,6 @@ module kinematics_cleavage_opening
use prec use prec
use IO use IO
use config use config
use debug
use math use math
use lattice use lattice
use material use material
@ -49,11 +48,10 @@ subroutine kinematics_cleavage_opening_init
integer, dimension(:), allocatable :: N_cl !< active number of cleavage systems per family integer, dimension(:), allocatable :: N_cl !< active number of cleavage systems per family
character(len=pStringLen) :: extmsg = '' character(len=pStringLen) :: extmsg = ''
write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_CLEAVAGE_OPENING_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_CLEAVAGE_OPENING_LABEL//' init -+>>>'
Ninstance = count(phase_kinematics == KINEMATICS_CLEAVAGE_OPENING_ID) Ninstance = count(phase_kinematics == KINEMATICS_CLEAVAGE_OPENING_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(kinematics_cleavage_opening_instance(size(config_phase)), source=0) allocate(kinematics_cleavage_opening_instance(size(config_phase)), source=0)
allocate(param(Ninstance)) allocate(param(Ninstance))

6
src/kinematics_slipplane_opening.f90
View File

@ -8,7 +8,6 @@ module kinematics_slipplane_opening
use prec use prec
use config use config
use IO use IO
use debug
use math use math
use lattice use lattice
use material use material
@ -52,11 +51,10 @@ subroutine kinematics_slipplane_opening_init
integer, dimension(:), allocatable :: N_sl integer, dimension(:), allocatable :: N_sl
real(pReal), dimension(:,:), allocatable :: d,n,t real(pReal), dimension(:,:), allocatable :: d,n,t
write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_SLIPPLANE_OPENING_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_SLIPPLANE_OPENING_LABEL//' init -+>>>'
Ninstance = count(phase_kinematics == KINEMATICS_SLIPPLANE_OPENING_ID) Ninstance = count(phase_kinematics == KINEMATICS_SLIPPLANE_OPENING_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(kinematics_slipplane_opening_instance(size(config_phase)), source=0) allocate(kinematics_slipplane_opening_instance(size(config_phase)), source=0)
allocate(param(Ninstance)) allocate(param(Ninstance))

6
src/kinematics_thermal_expansion.f90
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@ -7,7 +7,6 @@ module kinematics_thermal_expansion
use prec use prec
use IO use IO
use config use config
use debug
use math use math
use lattice use lattice
use material use material
@ -43,11 +42,10 @@ subroutine kinematics_thermal_expansion_init
integer :: Ninstance,p,i integer :: Ninstance,p,i
real(pReal), dimension(:), allocatable :: temp real(pReal), dimension(:), allocatable :: temp
write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_thermal_expansion_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_thermal_expansion_LABEL//' init -+>>>'
Ninstance = count(phase_kinematics == KINEMATICS_thermal_expansion_ID) Ninstance = count(phase_kinematics == KINEMATICS_thermal_expansion_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(kinematics_thermal_expansion_instance(size(config_phase)), source=0) allocate(kinematics_thermal_expansion_instance(size(config_phase)), source=0)
allocate(param(Ninstance)) allocate(param(Ninstance))

11
src/marc/discretization_marc.f90
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@ -13,7 +13,6 @@ module discretization_marc
use IO use IO
use debug use debug
use numerics use numerics
use YAML_types
use FEsolving use FEsolving
use element use element
use discretization use discretization
@ -58,7 +57,8 @@ subroutine discretization_marc_init
homogenizationAt homogenizationAt
integer:: & integer:: &
Nnodes, & !< total number of nodes in the mesh Nnodes, & !< total number of nodes in the mesh
Nelems !< total number of elements in the mesh Nelems, & !< total number of elements in the mesh
debug_e, debug_i
real(pReal), dimension(:,:), allocatable :: & real(pReal), dimension(:,:), allocatable :: &
IP_reshaped IP_reshaped
@ -74,6 +74,13 @@ subroutine discretization_marc_init
write(6,'(/,a)') ' <<<+- discretization_marc init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- discretization_marc init -+>>>'; flush(6)
!---------------------------------------------------------------------------------
! read debug parameters
debug_e = debug_root%get_asInt('element',defaultVal=1)
debug_i = debug_root%get_asInt('integrationpoint',defaultVal=1)
!--------------------------------------------------------------------------------
! read numerics parameter and do sanity check
num_commercialFEM => numerics_root%get('commercialFEM',defaultVal = emptyDict) num_commercialFEM => numerics_root%get('commercialFEM',defaultVal = emptyDict)
mesh_unitlength = num_commercialFEM%get_asFloat('unitlength',defaultVal=1.0_pReal) ! set physical extent of a length unit in mesh mesh_unitlength = num_commercialFEM%get_asFloat('unitlength',defaultVal=1.0_pReal) ! set physical extent of a length unit in mesh
if (mesh_unitlength <= 0.0_pReal) call IO_error(301,ext_msg='unitlength') if (mesh_unitlength <= 0.0_pReal) call IO_error(301,ext_msg='unitlength')

15
src/material.f90
View File

@ -215,22 +215,23 @@ subroutine material_init(restart)
integer, dimension(:), allocatable :: & integer, dimension(:), allocatable :: &
CounterPhase, & CounterPhase, &
CounterHomogenization CounterHomogenization
class(tNode), pointer :: &
myDebug = debug_level(debug_material) debug_material ! pointer to material debug options
write(6,'(/,a)') ' <<<+- material init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- material init -+>>>'; flush(6)
debug_material => debug_root%get('material',defaultVal=emptyList)
call material_parsePhase() call material_parsePhase()
if (iand(myDebug,debug_levelBasic) /= 0) write(6,'(a)') ' Phase parsed'; flush(6) if (debug_material%contains('basic')) write(6,'(a)') ' Phase parsed'; flush(6)
call material_parseMicrostructure() call material_parseMicrostructure()
if (iand(myDebug,debug_levelBasic) /= 0) write(6,'(a)') ' Microstructure parsed'; flush(6) if (debug_material%contains('basic')) write(6,'(a)') ' Microstructure parsed'; flush(6)
call material_parseHomogenization() call material_parseHomogenization()
if (iand(myDebug,debug_levelBasic) /= 0) write(6,'(a)') ' Homogenization parsed'; flush(6) if (debug_material%contains('basic')) write(6,'(a)') ' Homogenization parsed'; flush(6)
call material_parseTexture() call material_parseTexture()
if (iand(myDebug,debug_levelBasic) /= 0) write(6,'(a)') ' Texture parsed'; flush(6) if (debug_material%contains('basic')) write(6,'(a)') ' Texture parsed'; flush(6)
material_Nphase = size(config_phase) material_Nphase = size(config_phase)
material_Nhomogenization = size(config_homogenization) material_Nhomogenization = size(config_homogenization)
@ -266,7 +267,7 @@ subroutine material_init(restart)
enddo enddo
if(homogenization_maxNgrains > size(microstructure_phase,1)) call IO_error(148) if(homogenization_maxNgrains > size(microstructure_phase,1)) call IO_error(148)
debugOut: if (iand(myDebug,debug_levelExtensive) /= 0) then debugOut: if (debug_material%contains('extensive')) then
write(6,'(/,a,/)') ' MATERIAL configuration' write(6,'(/,a,/)') ' MATERIAL configuration'
write(6,'(a32,1x,a16,1x,a6)') 'homogenization ','type ','grains' write(6,'(a32,1x,a16,1x,a6)') 'homogenization ','type ','grains'
do h = 1,size(config_homogenization) do h = 1,size(config_homogenization)

1
src/mesh/DAMASK_mesh.f90
View File

@ -16,7 +16,6 @@ program DAMASK_mesh
use CPFEM2 use CPFEM2
use FEsolving use FEsolving
use numerics use numerics
use YAML_types
use discretization_mesh use discretization_mesh
use FEM_Utilities use FEM_Utilities
use mesh_mech_FEM use mesh_mech_FEM

11
src/mesh/FEM_utilities.f90
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@ -15,7 +15,6 @@ module FEM_utilities
use FEsolving use FEsolving
use homogenization use homogenization
use numerics use numerics
use YAML_types
use debug use debug
use math use math
use discretization_mesh use discretization_mesh
@ -104,8 +103,12 @@ subroutine FEM_utilities_init
character(len=pStringLen) :: petsc_optionsOrder character(len=pStringLen) :: petsc_optionsOrder
class(tNode), pointer :: & class(tNode), pointer :: &
num_mesh num_mesh, &
debug_mesh ! pointer to mesh debug options
integer :: structOrder !< order of displacement shape functions integer :: structOrder !< order of displacement shape functions
character(len=*), parameter :: &
PETSCDEBUG = ' -snes_view -snes_monitor '
PetscErrorCode :: ierr PetscErrorCode :: ierr
write(6,'(/,a)') ' <<<+- DAMASK_FEM_utilities init -+>>>' write(6,'(/,a)') ' <<<+- DAMASK_FEM_utilities init -+>>>'
@ -115,7 +118,9 @@ subroutine FEM_utilities_init
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
! set debugging parameters ! set debugging parameters
debugPETSc = iand(debug_level(debug_SPECTRAL),debug_SPECTRALPETSC) /= 0 debug_mesh => debug_root%get('mesh',defaultVal=emptyList)
debugPETSc = debug_mesh%contains('petsc')
if(debugPETSc) write(6,'(3(/,a),/)') & if(debugPETSc) write(6,'(3(/,a),/)') &
' Initializing PETSc with debug options: ', & ' Initializing PETSc with debug options: ', &
trim(PETScDebug), & trim(PETScDebug), &

14
src/mesh/discretization_mesh.f90
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@ -68,7 +68,8 @@ subroutine discretization_mesh_init(restart)
integer, allocatable, dimension(:) :: chunkPos integer, allocatable, dimension(:) :: chunkPos
integer :: dimPlex, & integer :: dimPlex, &
mesh_Nnodes, & !< total number of nodes in mesh mesh_Nnodes, & !< total number of nodes in mesh
j, l j, l, &
debug_element, debug_ip
PetscSF :: sf PetscSF :: sf
DM :: globalMesh DM :: globalMesh
PetscInt :: nFaceSets PetscInt :: nFaceSets
@ -85,9 +86,16 @@ subroutine discretization_mesh_init(restart)
write(6,'(/,a)') ' <<<+- mesh init -+>>>' write(6,'(/,a)') ' <<<+- mesh init -+>>>'
!--------------------------------------------------------------------------------
! read numerics parameter
num_mesh => numerics_root%get('mesh',defaultVal=emptyDict) num_mesh => numerics_root%get('mesh',defaultVal=emptyDict)
integrationOrder = num_mesh%get_asInt('integrationorder',defaultVal = 2) integrationOrder = num_mesh%get_asInt('integrationorder',defaultVal = 2)
!---------------------------------------------------------------------------------
! read debug parameters
debug_element = debug_root%get_asInt('element',defaultVal=1)
debug_ip = debug_root%get_asInt('integrationpoint',defaultVal=1)
call DMPlexCreateFromFile(PETSC_COMM_WORLD,geometryFile,PETSC_TRUE,globalMesh,ierr) call DMPlexCreateFromFile(PETSC_COMM_WORLD,geometryFile,PETSC_TRUE,globalMesh,ierr)
CHKERRQ(ierr) CHKERRQ(ierr)
@ -164,8 +172,8 @@ subroutine discretization_mesh_init(restart)
CHKERRQ(ierr) CHKERRQ(ierr)
end do end do
if (debug_e < 1 .or. debug_e > mesh_NcpElems) call IO_error(602,ext_msg='element') if (debug_element < 1 .or. debug_element > mesh_NcpElems) call IO_error(602,ext_msg='element')
if (debug_i < 1 .or. debug_i > mesh_maxNips) call IO_error(602,ext_msg='IP') if (debug_ip < 1 .or. debug_ip > mesh_maxNips) call IO_error(602,ext_msg='IP')
FEsolving_execElem = [1,mesh_NcpElems] ! parallel loop bounds set to comprise all DAMASK elements FEsolving_execElem = [1,mesh_NcpElems] ! parallel loop bounds set to comprise all DAMASK elements
FEsolving_execIP = [1,mesh_maxNips] FEsolving_execIP = [1,mesh_maxNips]

1
src/mesh/mesh_mech_FEM.f90
View File

@ -19,7 +19,6 @@ module mesh_mech_FEM
use discretization_mesh use discretization_mesh
use DAMASK_interface use DAMASK_interface
use numerics use numerics
use YAML_types
use FEM_quadrature use FEM_quadrature
use homogenization use homogenization
use math use math

6
src/source_damage_anisoBrittle.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_damage_anisoBrittle module source_damage_anisoBrittle
use prec use prec
use debug
use IO use IO
use math use math
use discretization use discretization
@ -59,11 +58,10 @@ subroutine source_damage_anisoBrittle_init
integer, dimension(:), allocatable :: N_cl integer, dimension(:), allocatable :: N_cl
character(len=pStringLen) :: extmsg = '' character(len=pStringLen) :: extmsg = ''
write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ANISOBRITTLE_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ANISOBRITTLE_LABEL//' init -+>>>'
Ninstance = count(phase_source == SOURCE_DAMAGE_ANISOBRITTLE_ID) Ninstance = count(phase_source == SOURCE_DAMAGE_ANISOBRITTLE_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_damage_anisoBrittle_offset (size(config_phase)), source=0) allocate(source_damage_anisoBrittle_offset (size(config_phase)), source=0)
allocate(source_damage_anisoBrittle_instance(size(config_phase)), source=0) allocate(source_damage_anisoBrittle_instance(size(config_phase)), source=0)

6
src/source_damage_anisoDuctile.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_damage_anisoDuctile module source_damage_anisoDuctile
use prec use prec
use debug
use IO use IO
use math use math
use discretization use discretization
@ -52,11 +51,10 @@ subroutine source_damage_anisoDuctile_init
integer, dimension(:), allocatable :: N_sl integer, dimension(:), allocatable :: N_sl
character(len=pStringLen) :: extmsg = '' character(len=pStringLen) :: extmsg = ''
write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ANISODUCTILE_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ANISODUCTILE_LABEL//' init -+>>>'
Ninstance = count(phase_source == SOURCE_DAMAGE_ANISODUCTILE_ID) Ninstance = count(phase_source == SOURCE_DAMAGE_ANISODUCTILE_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_damage_anisoDuctile_offset (size(config_phase)), source=0) allocate(source_damage_anisoDuctile_offset (size(config_phase)), source=0)
allocate(source_damage_anisoDuctile_instance(size(config_phase)), source=0) allocate(source_damage_anisoDuctile_instance(size(config_phase)), source=0)

6
src/source_damage_isoBrittle.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_damage_isoBrittle module source_damage_isoBrittle
use prec use prec
use debug
use IO use IO
use math use math
use discretization use discretization
@ -50,11 +49,10 @@ subroutine source_damage_isoBrittle_init
integer :: Ninstance,sourceOffset,NipcMyPhase,p integer :: Ninstance,sourceOffset,NipcMyPhase,p
character(len=pStringLen) :: extmsg = '' character(len=pStringLen) :: extmsg = ''
write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ISOBRITTLE_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ISOBRITTLE_LABEL//' init -+>>>'
Ninstance = count(phase_source == SOURCE_DAMAGE_ISOBRITTLE_ID) Ninstance = count(phase_source == SOURCE_DAMAGE_ISOBRITTLE_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_damage_isoBrittle_offset (size(config_phase)), source=0) allocate(source_damage_isoBrittle_offset (size(config_phase)), source=0)
allocate(source_damage_isoBrittle_instance(size(config_phase)), source=0) allocate(source_damage_isoBrittle_instance(size(config_phase)), source=0)

6
src/source_damage_isoDuctile.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_damage_isoDuctile module source_damage_isoDuctile
use prec use prec
use debug
use IO use IO
use discretization use discretization
use material use material
@ -49,11 +48,10 @@ subroutine source_damage_isoDuctile_init
integer :: Ninstance,sourceOffset,NipcMyPhase,p integer :: Ninstance,sourceOffset,NipcMyPhase,p
character(len=pStringLen) :: extmsg = '' character(len=pStringLen) :: extmsg = ''
write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ISODUCTILE_LABEL//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_DAMAGE_ISODUCTILE_LABEL//' init -+>>>'
Ninstance = count(phase_source == SOURCE_DAMAGE_ISODUCTILE_ID) Ninstance = count(phase_source == SOURCE_DAMAGE_ISODUCTILE_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_damage_isoDuctile_offset (size(config_phase)), source=0) allocate(source_damage_isoDuctile_offset (size(config_phase)), source=0)
allocate(source_damage_isoDuctile_instance(size(config_phase)), source=0) allocate(source_damage_isoDuctile_instance(size(config_phase)), source=0)

6
src/source_thermal_dissipation.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_thermal_dissipation module source_thermal_dissipation
use prec use prec
use debug
use discretization use discretization
use material use material
use config use config
@ -41,11 +40,10 @@ subroutine source_thermal_dissipation_init
integer :: Ninstance,sourceOffset,NipcMyPhase,p integer :: Ninstance,sourceOffset,NipcMyPhase,p
write(6,'(/,a)') ' <<<+- source_'//SOURCE_thermal_dissipation_label//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_thermal_dissipation_label//' init -+>>>'
Ninstance = count(phase_source == SOURCE_THERMAL_DISSIPATION_ID) Ninstance = count(phase_source == SOURCE_THERMAL_DISSIPATION_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_thermal_dissipation_offset (size(config_phase)), source=0) allocate(source_thermal_dissipation_offset (size(config_phase)), source=0)
allocate(source_thermal_dissipation_instance(size(config_phase)), source=0) allocate(source_thermal_dissipation_instance(size(config_phase)), source=0)

6
src/source_thermal_externalheat.f90
View File

@ -6,7 +6,6 @@
!-------------------------------------------------------------------------------------------------- !--------------------------------------------------------------------------------------------------
module source_thermal_externalheat module source_thermal_externalheat
use prec use prec
use debug
use discretization use discretization
use material use material
use config use config
@ -45,11 +44,10 @@ subroutine source_thermal_externalheat_init
integer :: Ninstance,sourceOffset,NipcMyPhase,p integer :: Ninstance,sourceOffset,NipcMyPhase,p
write(6,'(/,a)') ' <<<+- source_'//SOURCE_thermal_externalheat_label//' init -+>>>'; flush(6) write(6,'(/,a)') ' <<<+- source_'//SOURCE_thermal_externalheat_label//' init -+>>>'
Ninstance = count(phase_source == SOURCE_thermal_externalheat_ID) Ninstance = count(phase_source == SOURCE_thermal_externalheat_ID)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0) & write(6,'(a16,1x,i5,/)') '# instances:',Ninstance; flush(6)
write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
allocate(source_thermal_externalheat_offset (size(config_phase)), source=0) allocate(source_thermal_externalheat_offset (size(config_phase)), source=0)
allocate(source_thermal_externalheat_instance(size(config_phase)), source=0) allocate(source_thermal_externalheat_instance(size(config_phase)), source=0)