Merge branch '30_parsePhasePartOnce' into 19-NewStylePhenopowerlaw

This commit is contained in:
Martin Diehl 2018-06-26 21:04:10 +02:00
commit 2bc919e4e3
7 changed files with 363 additions and 299 deletions

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@ -560,8 +560,8 @@ function IO_hybridIA(Nast,ODFfileName)
IO_hybridIA = 0.0_pReal ! initialize return value for case of error
write(6,'(/,a,/)',advance='no') ' Using linear ODF file: '//trim(ODFfileName)
write(6,'(/,a)') 'Eisenlohr et al., Computational Materials Science, 42(4):670678, 2008'
write(6,'(/,a)') 'https://doi.org/10.1016/j.commatsci.2007.09.015'
write(6,'(/,a)') ' Eisenlohr et al., Computational Materials Science, 42(4):670678, 2008'
write(6,'(a)') ' https://doi.org/10.1016/j.commatsci.2007.09.015'
!--------------------------------------------------------------------------------------------------

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@ -24,6 +24,7 @@ module config
contains
procedure :: add => add
procedure :: show => show
procedure :: free => free
procedure :: keyExists => keyExists
procedure :: countKeys => countKeys
@ -40,12 +41,12 @@ module config
type(tPartitionedStringList), public :: emptyList
type(tPartitionedStringList), public, protected, allocatable, dimension(:) :: &
phaseConfig, &
microstructureConfig, &
homogenizationConfig, &
textureConfig, &
crystalliteConfig
type(tPartitionedStringList), public, protected, allocatable, dimension(:) :: & ! QUESTION: rename to config_XXX?
config_phase, &
config_microstructure, &
config_homogenization, &
config_texture, &
config_crystallite
character(len=64), dimension(:), allocatable, public, protected :: &
phase_name, & !< name of each phase
@ -59,12 +60,12 @@ module config
MATERIAL_partHomogenization = 'homogenization', & !< keyword for homogenization part
MATERIAL_partCrystallite = 'crystallite', & !< keyword for crystallite part
MATERIAL_partPhase = 'phase', & !< keyword for phase part
MATERIAL_partMicrostructure = 'microstructure', & !< keyword for microstructure part
MATERIAL_partMicrostructure = 'microstructure' !< keyword for microstructure part
character(len=*), parameter, private :: &
MATERIAL_partTexture = 'texture' !< keyword for texture part
! ToDo: Remove, use size(phaseConfig) etc
! ToDo: Remove, use size(config_phase) etc
integer(pInt), public, protected :: &
material_Ntexture, & !< number of textures
material_Nphase, & !< number of phases
material_Nhomogenization, & !< number of homogenizations
material_Nmicrostructure, & !< number of microstructures
@ -76,10 +77,15 @@ module config
MATERIAL_localFileExt = 'materialConfig' !< extension of solver job name depending material configuration file
public :: config_init
public :: &
config_init, &
config_deallocate
contains
!--------------------------------------------------------------------------------------------------
!> @brief reads material.config and stores its content per part
!--------------------------------------------------------------------------------------------------
subroutine config_init()
#if defined(__GFORTRAN__) || __INTEL_COMPILER >= 1800
use, intrinsic :: iso_fortran_env, only: &
@ -108,13 +114,12 @@ subroutine config_init()
line, &
part
myDebug = debug_level(debug_material)
write(6,'(/,a)') ' <<<+- config init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
#include "compilation_info.f90"
myDebug = debug_level(debug_material)
if (.not. IO_open_jobFile_stat(FILEUNIT,material_localFileExt)) & ! no local material configuration present...
call IO_open_file(FILEUNIT,material_configFile) ! ...open material.config file
@ -126,23 +131,23 @@ subroutine config_init()
select case (trim(part))
case (trim(material_partPhase))
call parseFile(line,phase_name,phaseConfig,FILEUNIT)
call parseFile(line,phase_name,config_phase,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Phase parsed'; flush(6)
case (trim(material_partMicrostructure))
call parseFile(line,microstructure_name,microstructureConfig,FILEUNIT)
call parseFile(line,microstructure_name,config_microstructure,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Microstructure parsed'; flush(6)
case (trim(material_partCrystallite))
call parseFile(line,crystallite_name,crystalliteConfig,FILEUNIT)
call parseFile(line,crystallite_name,config_crystallite,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Crystallite parsed'; flush(6)
case (trim(material_partHomogenization))
call parseFile(line,homogenization_name,homogenizationConfig,FILEUNIT)
call parseFile(line,homogenization_name,config_homogenization,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Homogenization parsed'; flush(6)
case (trim(material_partTexture))
call parseFile(line,texture_name,textureConfig,FILEUNIT)
call parseFile(line,texture_name,config_texture,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Texture parsed'; flush(6)
case default
@ -152,22 +157,21 @@ subroutine config_init()
enddo
material_Nhomogenization = size(homogenizationConfig)
material_Nhomogenization = size(config_homogenization)
if (material_Nhomogenization < 1_pInt) call IO_error(160_pInt,ext_msg=material_partHomogenization)
material_Nmicrostructure = size(microstructureConfig)
material_Nmicrostructure = size(config_microstructure)
if (material_Nmicrostructure < 1_pInt) call IO_error(160_pInt,ext_msg=material_partMicrostructure)
material_Ncrystallite = size(crystalliteConfig)
material_Ncrystallite = size(config_crystallite)
if (material_Ncrystallite < 1_pInt) call IO_error(160_pInt,ext_msg=material_partCrystallite)
material_Nphase = size(phaseConfig)
material_Nphase = size(config_phase)
if (material_Nphase < 1_pInt) call IO_error(160_pInt,ext_msg=material_partPhase)
material_Ntexture = size(textureConfig)
if (material_Ntexture < 1_pInt) call IO_error(160_pInt,ext_msg=material_partTexture)
if (size(config_texture) < 1_pInt) call IO_error(160_pInt,ext_msg=material_partTexture)
end subroutine config_init
!--------------------------------------------------------------------------------------------------
!> @brief parses the homogenization part in the material configuration file
!> @brief parses the material.config file
!--------------------------------------------------------------------------------------------------
subroutine parseFile(line,&
sectionNames,part,fileUnit)
@ -201,7 +205,7 @@ subroutine parseFile(line,&
line = IO_read(fileUnit)
if (IO_isBlank(line)) cycle ! skip empty lines
foundNextPart: if (IO_getTag(line,'<','>') /= '') then
devNull = IO_read(fileUnit, .true.) ! reset IO_read
devNull = IO_read(fileUnit, .true.) ! reset IO_read to close any recursively included files
exit
endif foundNextPart
nextSection: if (IO_getTag(line,'[',']') /= '') then
@ -213,6 +217,7 @@ subroutine parseFile(line,&
else GfortranBug86033
sectionNames = [sectionNames,tag]
endif GfortranBug86033
cycle
endif nextSection
chunkPos = IO_stringPos(line)
tag = IO_lc(IO_stringValue(trim(line),chunkPos,1_pInt)) ! extract key
@ -228,8 +233,57 @@ subroutine parseFile(line,&
call part(s)%show()
end do
end if
end subroutine parseFile
subroutine config_deallocate(what)
use IO, only: &
IO_error
implicit none
character(len=*), intent(in) :: what
integer(pInt) :: i
select case(what)
case('material.config/phase')
do i=1, size(config_phase)
call config_phase(i)%free
enddo
deallocate(config_phase)
case('material.config/microstructure')
do i=1, size(config_microstructure)
call config_microstructure(i)%free
enddo
deallocate(config_microstructure)
case('material.config/crystallite')
do i=1, size(config_crystallite)
call config_crystallite(i)%free
enddo
deallocate(config_crystallite)
case('material.config/homogenization')
do i=1, size(config_homogenization)
call config_homogenization(i)%free
enddo
deallocate(config_homogenization)
case('material.config/texture')
do i=1, size(config_texture)
call config_texture(i)%free
enddo
deallocate(config_texture)
case default
call IO_error(0_pInt,ext_msg='config_deallocate')
end select
end subroutine config_deallocate
!--------------------------------------------------------------------------------------------------
!> @brief add element
!> @details Adds a string together with the start/end position of chunks in this string. The new
@ -282,23 +336,24 @@ end subroutine show
!--------------------------------------------------------------------------------------------------
!> @brief deallocates all elements of a given list
!> @details Strings are printed in order of insertion (FIFO)
!> @brief cleans entire list
!> @details list head is remains alive
!--------------------------------------------------------------------------------------------------
! subroutine free_all()
! implicit none
!
! type(node), pointer :: item
!
! do
! item => first
!
! if (associated(item) .eqv. .FALSE.) exit
!
! first => first%next
! deallocate(item)
! end do
! end subroutine free_all
subroutine free(this)
implicit none
class(tPartitionedStringList), target, intent(in) :: this
type(tPartitionedStringList), pointer :: new, item
item => this%next
do while (associated(item%next))
new => item
deallocate(item)
item => new%next
enddo
deallocate(item)
end subroutine free
!--------------------------------------------------------------------------------------------------
@ -368,8 +423,8 @@ real(pReal) function getFloat(this,key,defaultVal)
type(tPartitionedStringList), pointer :: item
logical :: found
if (present(defaultVal)) getFloat = defaultVal
found = present(defaultVal)
if (found) getFloat = defaultVal
item => this%next
do while (associated(item))
@ -404,8 +459,8 @@ integer(pInt) function getInt(this,key,defaultVal)
type(tPartitionedStringList), pointer :: item
logical :: found
if (present(defaultVal)) getInt = defaultVal
found = present(defaultVal)
if (found) getInt = defaultVal
item => this%next
do while (associated(item))
@ -440,11 +495,14 @@ character(len=65536) function getString(this,key,defaultVal,raw)
logical, intent(in), optional :: raw
type(tPartitionedStringList), pointer :: item
logical :: found, &
split
whole
if (present(defaultVal)) getString = trim(defaultVal)
split = merge(.not. raw,.true.,present(raw))
whole = merge(raw,.false.,present(raw)) ! whole string or white space splitting
found = present(defaultVal)
if (found) then
getString = trim(defaultVal)
if (len_trim(getString) /= len_trim(defaultVal)) call IO_error(0_pInt,ext_msg='getString')
endif
item => this%next
do while (associated(item))
@ -452,19 +510,17 @@ character(len=65536) function getString(this,key,defaultVal,raw)
found = .true.
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
if (split) then
getString = IO_StringValue(item%string%val,item%string%pos,2)
else
if (whole) then
getString = trim(item%string%val(item%string%pos(4):)) ! raw string starting a second chunk
else
getString = IO_StringValue(item%string%val,item%string%pos,2)
endif
endif
item => item%next
end do
if (.not. found) call IO_error(140_pInt,ext_msg=key)
if (present(defaultVal)) then
if(len_trim(getString)/=len_trim(defaultVal)) call IO_error(0_pInt,ext_msg='getString')
endif
end function getString
@ -498,10 +554,7 @@ function getFloats(this,key,defaultVal)
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (.not. cumulative) then
deallocate(getFloats) ! use here rhs allocation with empty list
allocate(getFloats(0))
endif
if (.not. cumulative) getFloats = [real(pReal)::]
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
do i = 2_pInt, item%string%pos(1)
getFloats = [getFloats,IO_FloatValue(item%string%val,item%string%pos,i)]
@ -510,11 +563,9 @@ function getFloats(this,key,defaultVal)
item => item%next
end do
if (present(defaultVal) .and. .not. found) then
getFloats = defaultVal
found = .true.
if (.not. found) then
if (present(defaultVal)) then; getFloats = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
if (.not. found) call IO_error(140_pInt,ext_msg=key)
end function getFloats
@ -549,10 +600,7 @@ function getInts(this,key,defaultVal)
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (.not. cumulative) then
deallocate(getInts) ! use here rhs allocation with empty list
allocate(getInts(0))
endif
if (.not. cumulative) getInts = [integer(pInt)::]
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
do i = 2_pInt, item%string%pos(1)
getInts = [getInts,IO_IntValue(item%string%val,item%string%pos,i)]
@ -561,11 +609,9 @@ function getInts(this,key,defaultVal)
item => item%next
end do
if (present(defaultVal) .and. .not. found) then
getInts = defaultVal
found = .true.
if (.not. found) then
if (present(defaultVal)) then; getInts = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
if (.not. found) call IO_error(140_pInt,ext_msg=key)
end function getInts
@ -591,11 +637,11 @@ function getStrings(this,key,defaultVal,raw)
character(len=65536) :: str
integer(pInt) :: i
logical :: found, &
split, &
whole, &
cumulative
cumulative = (key(1:1) == '(' .and. key(len_trim(key):len_trim(key)) == ')')
split = merge(.not. raw,.true.,present(raw))
whole = merge(raw,.false.,present(raw))
found = .false.
item => this%next
@ -606,36 +652,34 @@ function getStrings(this,key,defaultVal,raw)
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
notAllocated: if (.not. allocated(getStrings)) then
if (split) then
if (whole) then
str = item%string%val(item%string%pos(4):)
getStrings = [str]
else
str = IO_StringValue(item%string%val,item%string%pos,2_pInt)
allocate(getStrings(1),source=str)
do i=3_pInt,item%string%pos(1)
str = IO_StringValue(item%string%val,item%string%pos,i)
getStrings = [getStrings,str]
enddo
else
str = item%string%val(item%string%pos(4):)
getStrings = [str]
endif
else notAllocated
if (split) then
if (whole) then
getStrings = [getStrings,str]
else
do i=2_pInt,item%string%pos(1)
str = IO_StringValue(item%string%val,item%string%pos,i)
getStrings = [getStrings,str]
enddo
else
getStrings = [getStrings,str]
endif
endif notAllocated
endif
item => item%next
end do
if (present(defaultVal) .and. .not. found) then
getStrings = defaultVal
found = .true.
if (.not. found) then
if (present(defaultVal)) then; getStrings = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
if (.not. found) call IO_error(140_pInt,ext_msg=key)
end function getStrings

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@ -57,6 +57,8 @@ subroutine constitutive_init()
IO_write_jobFile, &
IO_write_jobIntFile, &
IO_timeStamp
use config, only: &
config_deallocate
use mesh, only: &
FE_geomtype
use config, only: &
@ -190,6 +192,8 @@ subroutine constitutive_init()
if (any(phase_kinematics == KINEMATICS_hydrogen_strain_ID)) call kinematics_hydrogen_strain_init(FILEUNIT)
close(FILEUNIT)
call config_deallocate('material.config/phase')
write(6,'(/,a)') ' <<<+- constitutive init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
#include "compilation_info.f90"
@ -336,30 +340,6 @@ subroutine constitutive_init()
enddo PhaseLoop2
#ifdef TODO
!--------------------------------------------------------------------------------------------------
! report
constitutive_maxSizeState = maxval(constitutive_sizeState)
constitutive_plasticity_maxSizeDotState = maxval(constitutive_sizeDotState)
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0_pInt) then
write(6,'(a32,1x,7(i8,1x))') 'constitutive_state0: ', shape(constitutive_state0)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_partionedState0: ', shape(constitutive_partionedState0)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_subState0: ', shape(constitutive_subState0)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_state: ', shape(constitutive_state)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_aTolState: ', shape(constitutive_aTolState)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_dotState: ', shape(constitutive_dotState)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_deltaState: ', shape(constitutive_deltaState)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_sizeState: ', shape(constitutive_sizeState)
write(6,'(a32,1x,7(i8,1x))') 'constitutive_sizeDotState: ', shape(constitutive_sizeDotState)
write(6,'(a32,1x,7(i8,1x),/)') 'constitutive_sizePostResults: ', shape(constitutive_sizePostResults)
write(6,'(a32,1x,7(i8,1x))') 'maxSizeState: ', constitutive_maxSizeState
write(6,'(a32,1x,7(i8,1x))') 'maxSizeDotState: ', constitutive_plasticity_maxSizeDotState
write(6,'(a32,1x,7(i8,1x))') 'maxSizePostResults: ', constitutive_plasticity_maxSizePostResults
endif
flush(6)
#endif
end subroutine constitutive_init

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@ -171,7 +171,10 @@ subroutine crystallite_init
IO_write_jobFile, &
IO_error
use material
use config
use config, only: &
config_crystallite, &
crystallite_name, &
config_deallocate
use constitutive, only: &
constitutive_initialFi, &
constitutive_microstructure ! derived (shortcut) quantities of given state
@ -259,21 +262,21 @@ subroutine crystallite_init
allocate(crystallite_clearToCutback(iMax,eMax), source=.true.)
allocate(crystallite_neighborEnforcedCutback(iMax,eMax), source=.false.)
allocate(crystallite_output(maxval(crystallite_Noutput), &
material_Ncrystallite)) ; crystallite_output = ''
size(config_crystallite))) ; crystallite_output = ''
allocate(crystallite_outputID(maxval(crystallite_Noutput), &
material_Ncrystallite), source=undefined_ID)
allocate(crystallite_sizePostResults(material_Ncrystallite),source=0_pInt)
size(config_crystallite)), source=undefined_ID)
allocate(crystallite_sizePostResults(size(config_crystallite)),source=0_pInt)
allocate(crystallite_sizePostResult(maxval(crystallite_Noutput), &
material_Ncrystallite), source=0_pInt)
size(config_crystallite)), source=0_pInt)
do c = 1_pInt, material_Ncrystallite
do c = 1_pInt, size(config_crystallite)
#if defined(__GFORTRAN__)
str = ['GfortranBug86277']
str = crystalliteConfig(c)%getStrings('(output)',defaultVal=str)
str = config_crystallite(c)%getStrings('(output)',defaultVal=str)
if (str(1) == 'GfortranBug86277') str = [character(len=65536)::]
#else
str = crystalliteConfig(c)%getStrings('(output)',defaultVal=[character(len=65536)::])
str = config_crystallite(c)%getStrings('(output)',defaultVal=[character(len=65536)::])
#endif
do o = 1_pInt, size(str)
crystallite_output(o,c) = str(o)
@ -329,7 +332,7 @@ subroutine crystallite_init
enddo
do r = 1_pInt,material_Ncrystallite
do r = 1_pInt,size(config_crystallite)
do o = 1_pInt,crystallite_Noutput(r)
select case(crystallite_outputID(o,r))
case(phase_ID,texture_ID,volume_ID,grainrotationx_ID,grainrotationy_ID,grainrotationz_ID)
@ -354,14 +357,14 @@ subroutine crystallite_init
crystallite_maxSizePostResults = &
maxval(crystallite_sizePostResults(microstructure_crystallite),microstructure_active)
!--------------------------------------------------------------------------------------------------
! write description file for crystallite output
if (worldrank == 0_pInt) then
call IO_write_jobFile(FILEUNIT,'outputCrystallite')
do r = 1_pInt,material_Ncrystallite
do r = 1_pInt,size(config_crystallite)
if (any(microstructure_crystallite(mesh_element(4,:)) == r)) then
write(FILEUNIT,'(/,a,/)') '['//trim(crystallite_name(r))//']'
do o = 1_pInt,crystallite_Noutput(r)
@ -373,6 +376,8 @@ subroutine crystallite_init
close(FILEUNIT)
endif
call config_deallocate('material.config/crystallite')
!--------------------------------------------------------------------------------------------------
! initialize
!$OMP PARALLEL DO PRIVATE(myNcomponents)

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@ -100,8 +100,13 @@ subroutine homogenization_init
use crystallite, only: &
crystallite_maxSizePostResults
#endif
use config, only: &
config_deallocate, &
material_configFile, &
material_localFileExt, &
config_homogenization, &
homogenization_name
use material
use config
use homogenization_none
use homogenization_isostrain
use homogenization_RGC
@ -197,7 +202,7 @@ subroutine homogenization_init
! write description file for homogenization output
mainProcess2: if (worldrank == 0) then
call IO_write_jobFile(FILEUNIT,'outputHomogenization')
do p = 1,material_Nhomogenization
do p = 1,size(config_homogenization)
if (any(material_homog == p)) then
i = homogenization_typeInstance(p) ! which instance of this homogenization type
valid = .true. ! assume valid
@ -370,6 +375,8 @@ subroutine homogenization_init
close(FILEUNIT)
endif mainProcess2
call config_deallocate('material.config/homogenization')
!--------------------------------------------------------------------------------------------------
! allocate and initialize global variables
allocate(materialpoint_dPdF(3,3,3,3,mesh_maxNips,mesh_NcpElems), source=0.0_pReal)
@ -395,7 +402,7 @@ subroutine homogenization_init
vacancyflux_maxSizePostResults = 0_pInt
porosity_maxSizePostResults = 0_pInt
hydrogenflux_maxSizePostResults = 0_pInt
do p = 1,material_Nhomogenization
do p = 1,size(config_homogenization)
homogenization_maxSizePostResults = max(homogenization_maxSizePostResults,homogState (p)%sizePostResults)
thermal_maxSizePostResults = max(thermal_maxSizePostResults, thermalState (p)%sizePostResults)
damage_maxSizePostResults = max(damage_maxSizePostResults ,damageState (p)%sizePostResults)

View File

@ -1,13 +1,13 @@
!--------------------------------------------------------------------------------------------------
!> @author Franz Roters, Max-Planck-Institut für Eisenforschung GmbH
!> @author Philip Eisenlohr, Max-Planck-Institut für Eisenforschung GmbH
!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
!> @brief Parses material config file, either solverJobName.materialConfig or material.config
!> @details reads the material configuration file, where solverJobName.materialConfig takes
!! precedence over material.config and parses the sections 'homogenization', 'crystallite',
!! 'phase', 'texture', and 'microstucture'
!--------------------------------------------------------------------------------------------------
module material
use config
use prec, only: &
pReal, &
pInt, &
@ -351,6 +351,17 @@ subroutine material_init()
debug_material, &
debug_levelBasic, &
debug_levelExtensive
use config, only: &
config_crystallite, &
config_homogenization, &
config_microstructure, &
config_phase, &
config_texture, &
homogenization_name, &
microstructure_name, &
phase_name, &
texture_name, &
config_deallocate
use mesh, only: &
mesh_maxNips, &
mesh_NcpElems, &
@ -391,44 +402,44 @@ subroutine material_init()
call material_parseTexture()
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Texture parsed'; flush(6)
allocate(plasticState (material_Nphase))
allocate(sourceState (material_Nphase))
do myPhase = 1,material_Nphase
allocate(plasticState (size(config_phase)))
allocate(sourceState (size(config_phase)))
do myPhase = 1,size(config_phase)
allocate(sourceState(myPhase)%p(phase_Nsources(myPhase)))
enddo
allocate(homogState (material_Nhomogenization))
allocate(thermalState (material_Nhomogenization))
allocate(damageState (material_Nhomogenization))
allocate(vacancyfluxState (material_Nhomogenization))
allocate(porosityState (material_Nhomogenization))
allocate(hydrogenfluxState (material_Nhomogenization))
allocate(homogState (size(config_homogenization)))
allocate(thermalState (size(config_homogenization)))
allocate(damageState (size(config_homogenization)))
allocate(vacancyfluxState (size(config_homogenization)))
allocate(porosityState (size(config_homogenization)))
allocate(hydrogenfluxState (size(config_homogenization)))
allocate(thermalMapping (material_Nhomogenization))
allocate(damageMapping (material_Nhomogenization))
allocate(vacancyfluxMapping (material_Nhomogenization))
allocate(porosityMapping (material_Nhomogenization))
allocate(hydrogenfluxMapping(material_Nhomogenization))
allocate(thermalMapping (size(config_homogenization)))
allocate(damageMapping (size(config_homogenization)))
allocate(vacancyfluxMapping (size(config_homogenization)))
allocate(porosityMapping (size(config_homogenization)))
allocate(hydrogenfluxMapping(size(config_homogenization)))
allocate(temperature (material_Nhomogenization))
allocate(damage (material_Nhomogenization))
allocate(vacancyConc (material_Nhomogenization))
allocate(porosity (material_Nhomogenization))
allocate(hydrogenConc (material_Nhomogenization))
allocate(temperature (size(config_homogenization)))
allocate(damage (size(config_homogenization)))
allocate(vacancyConc (size(config_homogenization)))
allocate(porosity (size(config_homogenization)))
allocate(hydrogenConc (size(config_homogenization)))
allocate(temperatureRate (material_Nhomogenization))
allocate(vacancyConcRate (material_Nhomogenization))
allocate(hydrogenConcRate (material_Nhomogenization))
allocate(temperatureRate (size(config_homogenization)))
allocate(vacancyConcRate (size(config_homogenization)))
allocate(hydrogenConcRate (size(config_homogenization)))
do m = 1_pInt,material_Nmicrostructure
do m = 1_pInt,size(config_microstructure)
if(microstructure_crystallite(m) < 1_pInt .or. &
microstructure_crystallite(m) > material_Ncrystallite) &
microstructure_crystallite(m) > size(config_crystallite)) &
call IO_error(150_pInt,m,ext_msg='crystallite')
if(minval(microstructure_phase(1:microstructure_Nconstituents(m),m)) < 1_pInt .or. &
maxval(microstructure_phase(1:microstructure_Nconstituents(m),m)) > material_Nphase) &
maxval(microstructure_phase(1:microstructure_Nconstituents(m),m)) > size(config_phase)) &
call IO_error(150_pInt,m,ext_msg='phase')
if(minval(microstructure_texture(1:microstructure_Nconstituents(m),m)) < 1_pInt .or. &
maxval(microstructure_texture(1:microstructure_Nconstituents(m),m)) > material_Ntexture) &
maxval(microstructure_texture(1:microstructure_Nconstituents(m),m)) > size(config_texture)) &
call IO_error(150_pInt,m,ext_msg='texture')
if(microstructure_Nconstituents(m) < 1_pInt) &
call IO_error(151_pInt,m)
@ -437,11 +448,11 @@ subroutine material_init()
debugOut: if (iand(myDebug,debug_levelExtensive) /= 0_pInt) then
write(6,'(/,a,/)') ' MATERIAL configuration'
write(6,'(a32,1x,a16,1x,a6)') 'homogenization ','type ','grains'
do h = 1_pInt,material_Nhomogenization
do h = 1_pInt,size(config_homogenization)
write(6,'(1x,a32,1x,a16,1x,i6)') homogenization_name(h),homogenization_type(h),homogenization_Ngrains(h)
enddo
write(6,'(/,a14,18x,1x,a11,1x,a12,1x,a13)') 'microstructure','crystallite','constituents','homogeneous'
do m = 1_pInt,material_Nmicrostructure
do m = 1_pInt,size(config_microstructure)
write(6,'(1x,a32,1x,i11,1x,i12,1x,l13)') microstructure_name(m), &
microstructure_crystallite(m), &
microstructure_Nconstituents(m), &
@ -458,6 +469,7 @@ subroutine material_init()
endif debugOut
call material_populateGrains
call config_deallocate('material.config/microstructure')
allocate(phaseAt ( homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems),source=0_pInt)
allocate(phasememberAt ( homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems),source=0_pInt)
@ -465,9 +477,9 @@ subroutine material_init()
allocate(mappingCrystallite (2,homogenization_maxNgrains, mesh_NcpElems),source=0_pInt)
allocate(mappingHomogenizationConst( mesh_maxNips,mesh_NcpElems),source=1_pInt)
allocate(ConstitutivePosition (material_Nphase), source=0_pInt)
allocate(HomogenizationPosition(material_Nhomogenization),source=0_pInt)
allocate(CrystallitePosition (material_Nphase), source=0_pInt)
allocate(ConstitutivePosition (size(config_phase)), source=0_pInt)
allocate(HomogenizationPosition(size(config_homogenization)),source=0_pInt)
allocate(CrystallitePosition (size(config_phase)), source=0_pInt)
ElemLoop:do e = 1_pInt,mesh_NcpElems
myHomog = mesh_element(3,e)
@ -484,7 +496,7 @@ subroutine material_init()
enddo ElemLoop
! hack needed to initialize field values used during constitutive and crystallite initializations
do myHomog = 1,material_Nhomogenization
do myHomog = 1,size(config_homogenization)
thermalMapping (myHomog)%p => mappingHomogenizationConst
damageMapping (myHomog)%p => mappingHomogenizationConst
vacancyfluxMapping (myHomog)%p => mappingHomogenizationConst
@ -508,7 +520,7 @@ end subroutine material_init
!--------------------------------------------------------------------------------------------------
subroutine material_parseHomogenization
use config, only : &
homogenizationConfig
config_homogenization
use IO, only: &
IO_error
use mesh, only: &
@ -518,54 +530,54 @@ subroutine material_parseHomogenization
integer(pInt) :: h
character(len=65536) :: tag
allocate(homogenization_type(material_Nhomogenization), source=HOMOGENIZATION_undefined_ID)
allocate(thermal_type(material_Nhomogenization), source=THERMAL_isothermal_ID)
allocate(damage_type (material_Nhomogenization), source=DAMAGE_none_ID)
allocate(vacancyflux_type(material_Nhomogenization), source=VACANCYFLUX_isoconc_ID)
allocate(porosity_type (material_Nhomogenization), source=POROSITY_none_ID)
allocate(hydrogenflux_type(material_Nhomogenization), source=HYDROGENFLUX_isoconc_ID)
allocate(homogenization_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(thermal_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(damage_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(vacancyflux_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(porosity_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(hydrogenflux_typeInstance(material_Nhomogenization), source=0_pInt)
allocate(homogenization_Ngrains(material_Nhomogenization), source=0_pInt)
allocate(homogenization_Noutput(material_Nhomogenization), source=0_pInt)
allocate(homogenization_active(material_Nhomogenization), source=.false.) !!!!!!!!!!!!!!!
allocate(thermal_initialT(material_Nhomogenization), source=300.0_pReal)
allocate(damage_initialPhi(material_Nhomogenization), source=1.0_pReal)
allocate(vacancyflux_initialCv(material_Nhomogenization), source=0.0_pReal)
allocate(porosity_initialPhi(material_Nhomogenization), source=1.0_pReal)
allocate(hydrogenflux_initialCh(material_Nhomogenization), source=0.0_pReal)
allocate(homogenization_type(size(config_homogenization)), source=HOMOGENIZATION_undefined_ID)
allocate(thermal_type(size(config_homogenization)), source=THERMAL_isothermal_ID)
allocate(damage_type (size(config_homogenization)), source=DAMAGE_none_ID)
allocate(vacancyflux_type(size(config_homogenization)), source=VACANCYFLUX_isoconc_ID)
allocate(porosity_type (size(config_homogenization)), source=POROSITY_none_ID)
allocate(hydrogenflux_type(size(config_homogenization)), source=HYDROGENFLUX_isoconc_ID)
allocate(homogenization_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(thermal_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(damage_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(vacancyflux_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(porosity_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(hydrogenflux_typeInstance(size(config_homogenization)), source=0_pInt)
allocate(homogenization_Ngrains(size(config_homogenization)), source=0_pInt)
allocate(homogenization_Noutput(size(config_homogenization)), source=0_pInt)
allocate(homogenization_active(size(config_homogenization)), source=.false.) !!!!!!!!!!!!!!!
allocate(thermal_initialT(size(config_homogenization)), source=300.0_pReal)
allocate(damage_initialPhi(size(config_homogenization)), source=1.0_pReal)
allocate(vacancyflux_initialCv(size(config_homogenization)), source=0.0_pReal)
allocate(porosity_initialPhi(size(config_homogenization)), source=1.0_pReal)
allocate(hydrogenflux_initialCh(size(config_homogenization)), source=0.0_pReal)
forall (h = 1_pInt:material_Nhomogenization) homogenization_active(h) = any(mesh_element(3,:) == h)
forall (h = 1_pInt:size(config_homogenization)) homogenization_active(h) = any(mesh_element(3,:) == h)
do h=1_pInt, material_Nhomogenization
homogenization_Noutput(h) = homogenizationConfig(h)%countKeys('(output)')
do h=1_pInt, size(config_homogenization)
homogenization_Noutput(h) = config_homogenization(h)%countKeys('(output)')
tag = homogenizationConfig(h)%getString('mech')
tag = config_homogenization(h)%getString('mech')
select case (trim(tag))
case(HOMOGENIZATION_NONE_label)
homogenization_type(h) = HOMOGENIZATION_NONE_ID
homogenization_Ngrains(h) = 1_pInt
case(HOMOGENIZATION_ISOSTRAIN_label)
homogenization_type(h) = HOMOGENIZATION_ISOSTRAIN_ID
homogenization_Ngrains(h) = homogenizationConfig(h)%getInt('nconstituents')
homogenization_Ngrains(h) = config_homogenization(h)%getInt('nconstituents')
case(HOMOGENIZATION_RGC_label)
homogenization_type(h) = HOMOGENIZATION_RGC_ID
homogenization_Ngrains(h) = homogenizationConfig(h)%getInt('nconstituents')
homogenization_Ngrains(h) = config_homogenization(h)%getInt('nconstituents')
case default
call IO_error(500_pInt,ext_msg=trim(tag))
end select
homogenization_typeInstance(h) = count(homogenization_type==homogenization_type(h))
if (homogenizationConfig(h)%keyExists('thermal')) then
thermal_initialT(h) = homogenizationConfig(h)%getFloat('t0',defaultVal=300.0_pReal)
if (config_homogenization(h)%keyExists('thermal')) then
thermal_initialT(h) = config_homogenization(h)%getFloat('t0',defaultVal=300.0_pReal)
tag = homogenizationConfig(h)%getString('thermal')
tag = config_homogenization(h)%getString('thermal')
select case (trim(tag))
case(THERMAL_isothermal_label)
thermal_type(h) = THERMAL_isothermal_ID
@ -579,10 +591,10 @@ subroutine material_parseHomogenization
endif
if (homogenizationConfig(h)%keyExists('damage')) then
damage_initialPhi(h) = homogenizationConfig(h)%getFloat('initialdamage',defaultVal=1.0_pReal)
if (config_homogenization(h)%keyExists('damage')) then
damage_initialPhi(h) = config_homogenization(h)%getFloat('initialdamage',defaultVal=1.0_pReal)
tag = homogenizationConfig(h)%getString('damage')
tag = config_homogenization(h)%getString('damage')
select case (trim(tag))
case(DAMAGE_NONE_label)
damage_type(h) = DAMAGE_none_ID
@ -596,10 +608,10 @@ subroutine material_parseHomogenization
endif
if (homogenizationConfig(h)%keyExists('vacancyflux')) then
vacancyflux_initialCv(h) = homogenizationConfig(h)%getFloat('cv0',defaultVal=0.0_pReal)
if (config_homogenization(h)%keyExists('vacancyflux')) then
vacancyflux_initialCv(h) = config_homogenization(h)%getFloat('cv0',defaultVal=0.0_pReal)
tag = homogenizationConfig(h)%getString('vacancyflux')
tag = config_homogenization(h)%getString('vacancyflux')
select case (trim(tag))
case(VACANCYFLUX_isoconc_label)
vacancyflux_type(h) = VACANCYFLUX_isoconc_ID
@ -613,10 +625,10 @@ subroutine material_parseHomogenization
endif
if (homogenizationConfig(h)%keyExists('porosity')) then
if (config_homogenization(h)%keyExists('porosity')) then
!ToDo?
tag = homogenizationConfig(h)%getString('porosity')
tag = config_homogenization(h)%getString('porosity')
select case (trim(tag))
case(POROSITY_NONE_label)
porosity_type(h) = POROSITY_none_ID
@ -628,10 +640,10 @@ subroutine material_parseHomogenization
endif
if (homogenizationConfig(h)%keyExists('hydrogenflux')) then
hydrogenflux_initialCh(h) = homogenizationConfig(h)%getFloat('ch0',defaultVal=0.0_pReal)
if (config_homogenization(h)%keyExists('hydrogenflux')) then
hydrogenflux_initialCh(h) = config_homogenization(h)%getFloat('ch0',defaultVal=0.0_pReal)
tag = homogenizationConfig(h)%getString('hydrogenflux')
tag = config_homogenization(h)%getString('hydrogenflux')
select case (trim(tag))
case(HYDROGENFLUX_isoconc_label)
hydrogenflux_type(h) = HYDROGENFLUX_isoconc_ID
@ -645,7 +657,7 @@ subroutine material_parseHomogenization
enddo
do h=1_pInt, material_Nhomogenization
do h=1_pInt, size(config_homogenization)
homogenization_typeInstance(h) = count(homogenization_type(1:h) == homogenization_type(h))
thermal_typeInstance(h) = count(thermal_type (1:h) == thermal_type (h))
damage_typeInstance(h) = count(damage_type (1:h) == damage_type (h))
@ -671,6 +683,9 @@ subroutine material_parseMicrostructure
IO_stringValue, &
IO_stringPos, &
IO_error
use config, only: &
config_microstructure, &
microstructure_name
use mesh, only: &
mesh_element, &
mesh_NcpElems
@ -683,29 +698,29 @@ subroutine material_parseMicrostructure
character(len=65536) :: &
tag
allocate(microstructure_crystallite(material_Nmicrostructure), source=0_pInt)
allocate(microstructure_Nconstituents(material_Nmicrostructure), source=0_pInt)
allocate(microstructure_active(material_Nmicrostructure), source=.false.)
allocate(microstructure_elemhomo(material_Nmicrostructure), source=.false.)
allocate(microstructure_crystallite(size(config_microstructure)), source=0_pInt)
allocate(microstructure_Nconstituents(size(config_microstructure)), source=0_pInt)
allocate(microstructure_active(size(config_microstructure)), source=.false.)
allocate(microstructure_elemhomo(size(config_microstructure)), source=.false.)
if(any(mesh_element(4,1:mesh_NcpElems) > material_Nmicrostructure)) &
if(any(mesh_element(4,1:mesh_NcpElems) > size(config_microstructure))) &
call IO_error(155_pInt,ext_msg='More microstructures in geometry than sections in material.config')
forall (e = 1_pInt:mesh_NcpElems) microstructure_active(mesh_element(4,e)) = .true. ! current microstructure used in model? Elementwise view, maximum N operations for N elements
do m=1_pInt, material_Nmicrostructure
microstructure_Nconstituents(m) = microstructureConfig(m)%countKeys('(constituent)')
microstructure_crystallite(m) = microstructureConfig(m)%getInt('crystallite')
microstructure_elemhomo(m) = microstructureConfig(m)%keyExists('/elementhomogeneous/')
do m=1_pInt, size(config_microstructure)
microstructure_Nconstituents(m) = config_microstructure(m)%countKeys('(constituent)')
microstructure_crystallite(m) = config_microstructure(m)%getInt('crystallite')
microstructure_elemhomo(m) = config_microstructure(m)%keyExists('/elementhomogeneous/')
enddo
microstructure_maxNconstituents = maxval(microstructure_Nconstituents)
allocate(microstructure_phase (microstructure_maxNconstituents,material_Nmicrostructure),source=0_pInt)
allocate(microstructure_texture (microstructure_maxNconstituents,material_Nmicrostructure),source=0_pInt)
allocate(microstructure_fraction(microstructure_maxNconstituents,material_Nmicrostructure),source=0.0_pReal)
allocate(microstructure_phase (microstructure_maxNconstituents,size(config_microstructure)),source=0_pInt)
allocate(microstructure_texture (microstructure_maxNconstituents,size(config_microstructure)),source=0_pInt)
allocate(microstructure_fraction(microstructure_maxNconstituents,size(config_microstructure)),source=0.0_pReal)
do m=1_pInt, material_Nmicrostructure
str = microstructureConfig(m)%getStrings('(constituent)',raw=.true.)
do m=1_pInt, size(config_microstructure)
str = config_microstructure(m)%getStrings('(constituent)',raw=.true.)
do c = 1_pInt, size(str)
chunkPos = IO_stringPos(str(c))
@ -725,11 +740,11 @@ subroutine material_parseMicrostructure
enddo
enddo
do m = 1_pInt, material_Nmicrostructure
do m = 1_pInt, size(config_microstructure)
if (dNeq(sum(microstructure_fraction(:,m)),1.0_pReal)) &
call IO_error(153_pInt,ext_msg=microstructure_name(m))
enddo
end subroutine material_parseMicrostructure
@ -737,13 +752,15 @@ end subroutine material_parseMicrostructure
!> @brief parses the crystallite part in the material configuration file
!--------------------------------------------------------------------------------------------------
subroutine material_parseCrystallite
use config, only: &
config_crystallite
implicit none
integer(pInt) :: c
allocate(crystallite_Noutput(material_Ncrystallite),source=0_pInt)
do c=1_pInt, material_Ncrystallite
crystallite_Noutput(c) = crystalliteConfig(c)%countKeys('(output)')
allocate(crystallite_Noutput(size(config_crystallite)),source=0_pInt)
do c=1_pInt, size(config_crystallite)
crystallite_Noutput(c) = config_crystallite(c)%countKeys('(output)')
enddo
end subroutine material_parseCrystallite
@ -757,35 +774,37 @@ subroutine material_parsePhase
IO_error, &
IO_getTag, &
IO_stringValue
use config, only: &
config_phase
implicit none
integer(pInt) :: sourceCtr, kinematicsCtr, stiffDegradationCtr, p
character(len=65536), dimension(:), allocatable :: str
allocate(phase_elasticity(material_Nphase),source=ELASTICITY_undefined_ID)
allocate(phase_plasticity(material_Nphase),source=PLASTICITY_undefined_ID)
allocate(phase_Nsources(material_Nphase), source=0_pInt)
allocate(phase_Nkinematics(material_Nphase), source=0_pInt)
allocate(phase_NstiffnessDegradations(material_Nphase),source=0_pInt)
allocate(phase_Noutput(material_Nphase), source=0_pInt)
allocate(phase_localPlasticity(material_Nphase), source=.false.)
allocate(phase_elasticity(size(config_phase)),source=ELASTICITY_undefined_ID)
allocate(phase_plasticity(size(config_phase)),source=PLASTICITY_undefined_ID)
allocate(phase_Nsources(size(config_phase)), source=0_pInt)
allocate(phase_Nkinematics(size(config_phase)), source=0_pInt)
allocate(phase_NstiffnessDegradations(size(config_phase)),source=0_pInt)
allocate(phase_Noutput(size(config_phase)), source=0_pInt)
allocate(phase_localPlasticity(size(config_phase)), source=.false.)
do p=1_pInt, material_Nphase
phase_Noutput(p) = phaseConfig(p)%countKeys('(output)')
phase_Nsources(p) = phaseConfig(p)%countKeys('(source)')
phase_Nkinematics(p) = phaseConfig(p)%countKeys('(kinematics)')
phase_NstiffnessDegradations(p) = phaseConfig(p)%countKeys('(stiffness_degradation)')
phase_localPlasticity(p) = .not. phaseConfig(p)%KeyExists('/nonlocal/')
do p=1_pInt, size(config_phase)
phase_Noutput(p) = config_phase(p)%countKeys('(output)')
phase_Nsources(p) = config_phase(p)%countKeys('(source)')
phase_Nkinematics(p) = config_phase(p)%countKeys('(kinematics)')
phase_NstiffnessDegradations(p) = config_phase(p)%countKeys('(stiffness_degradation)')
phase_localPlasticity(p) = .not. config_phase(p)%KeyExists('/nonlocal/')
select case (phaseConfig(p)%getString('elasticity'))
select case (config_phase(p)%getString('elasticity'))
case (ELASTICITY_HOOKE_label)
phase_elasticity(p) = ELASTICITY_HOOKE_ID
case default
call IO_error(200_pInt,ext_msg=trim(phaseConfig(p)%getString('elasticity')))
call IO_error(200_pInt,ext_msg=trim(config_phase(p)%getString('elasticity')))
end select
select case (phaseConfig(p)%getString('plasticity'))
select case (config_phase(p)%getString('plasticity'))
case (PLASTICITY_NONE_label)
phase_plasticity(p) = PLASTICITY_NONE_ID
case (PLASTICITY_ISOTROPIC_label)
@ -801,22 +820,22 @@ subroutine material_parsePhase
case (PLASTICITY_NONLOCAL_label)
phase_plasticity(p) = PLASTICITY_NONLOCAL_ID
case default
call IO_error(201_pInt,ext_msg=trim(phaseConfig(p)%getString('plasticity')))
call IO_error(201_pInt,ext_msg=trim(config_phase(p)%getString('plasticity')))
end select
enddo
allocate(phase_source(maxval(phase_Nsources),material_Nphase), source=SOURCE_undefined_ID)
allocate(phase_kinematics(maxval(phase_Nkinematics),material_Nphase), source=KINEMATICS_undefined_ID)
allocate(phase_stiffnessDegradation(maxval(phase_NstiffnessDegradations),material_Nphase), &
allocate(phase_source(maxval(phase_Nsources),size(config_phase)), source=SOURCE_undefined_ID)
allocate(phase_kinematics(maxval(phase_Nkinematics),size(config_phase)), source=KINEMATICS_undefined_ID)
allocate(phase_stiffnessDegradation(maxval(phase_NstiffnessDegradations),size(config_phase)), &
source=STIFFNESS_DEGRADATION_undefined_ID)
do p=1_pInt, material_Nphase
do p=1_pInt, size(config_phase)
#if defined(__GFORTRAN__)
str = ['GfortranBug86277']
str = phaseConfig(p)%getStrings('(source)',defaultVal=str)
str = config_phase(p)%getStrings('(source)',defaultVal=str)
if (str(1) == 'GfortranBug86277') str = [character(len=65536)::]
#else
str = phaseConfig(p)%getStrings('(source)',defaultVal=[character(len=65536)::])
str = config_phase(p)%getStrings('(source)',defaultVal=[character(len=65536)::])
#endif
do sourceCtr = 1_pInt, size(str)
select case (trim(str(sourceCtr)))
@ -843,10 +862,10 @@ subroutine material_parsePhase
#if defined(__GFORTRAN__)
str = ['GfortranBug86277']
str = phaseConfig(p)%getStrings('(kinematics)',defaultVal=str)
str = config_phase(p)%getStrings('(kinematics)',defaultVal=str)
if (str(1) == 'GfortranBug86277') str = [character(len=65536)::]
#else
str = phaseConfig(p)%getStrings('(kinematics)',defaultVal=[character(len=65536)::])
str = config_phase(p)%getStrings('(kinematics)',defaultVal=[character(len=65536)::])
#endif
do kinematicsCtr = 1_pInt, size(str)
select case (trim(str(kinematicsCtr)))
@ -864,10 +883,10 @@ subroutine material_parsePhase
enddo
#if defined(__GFORTRAN__)
str = ['GfortranBug86277']
str = phaseConfig(p)%getStrings('(stiffness_degradation)',defaultVal=str)
str = config_phase(p)%getStrings('(stiffness_degradation)',defaultVal=str)
if (str(1) == 'GfortranBug86277') str = [character(len=65536)::]
#else
str = phaseConfig(p)%getStrings('(stiffness_degradation)',defaultVal=[character(len=65536)::])
str = config_phase(p)%getStrings('(stiffness_degradation)',defaultVal=[character(len=65536)::])
#endif
do stiffDegradationCtr = 1_pInt, size(str)
select case (trim(str(stiffDegradationCtr)))
@ -879,10 +898,10 @@ subroutine material_parsePhase
enddo
enddo
allocate(phase_plasticityInstance(material_Nphase), source=0_pInt)
allocate(phase_elasticityInstance(material_Nphase), source=0_pInt)
allocate(phase_plasticityInstance(size(config_phase)), source=0_pInt)
allocate(phase_elasticityInstance(size(config_phase)), source=0_pInt)
do p=1_pInt, material_Nphase
do p=1_pInt, size(config_phase)
phase_elasticityInstance(p) = count(phase_elasticity(1:p) == phase_elasticity(p))
phase_plasticityInstance(p) = count(phase_plasticity(1:p) == phase_plasticity(p))
enddo
@ -900,6 +919,9 @@ subroutine material_parseTexture
IO_stringPos, &
IO_floatValue, &
IO_stringValue
use config, only: &
config_texture, &
config_deallocate
use math, only: &
inRad, &
math_sampleRandomOri, &
@ -912,31 +934,31 @@ subroutine material_parseTexture
integer(pInt), dimension(:), allocatable :: chunkPos
character(len=65536) :: tag
allocate(texture_ODFfile(material_Ntexture)); texture_ODFfile=''
allocate(texture_symmetry(material_Ntexture), source=1_pInt)
allocate(texture_Ngauss(material_Ntexture), source=0_pInt)
allocate(texture_Nfiber(material_Ntexture), source=0_pInt)
allocate(texture_ODFfile(size(config_texture))); texture_ODFfile=''
allocate(texture_symmetry(size(config_texture)), source=1_pInt)
allocate(texture_Ngauss(size(config_texture)), source=0_pInt)
allocate(texture_Nfiber(size(config_texture)), source=0_pInt)
do t=1_pInt, material_Ntexture
texture_Ngauss(t) = textureConfig(t)%countKeys('(gauss)') &
+ textureConfig(t)%countKeys('(random)')
texture_Nfiber(t) = textureConfig(t)%countKeys('(fiber)')
do t=1_pInt, size(config_texture)
texture_Ngauss(t) = config_texture(t)%countKeys('(gauss)') &
+ config_texture(t)%countKeys('(random)')
texture_Nfiber(t) = config_texture(t)%countKeys('(fiber)')
enddo
texture_maxNgauss = maxval(texture_Ngauss)
texture_maxNfiber = maxval(texture_Nfiber)
allocate(texture_Gauss (5,texture_maxNgauss,material_Ntexture), source=0.0_pReal)
allocate(texture_Fiber (6,texture_maxNfiber,material_Ntexture), source=0.0_pReal)
allocate(texture_transformation(3,3,material_Ntexture), source=0.0_pReal)
texture_transformation = spread(math_I3,3,material_Ntexture)
allocate(texture_Gauss (5,texture_maxNgauss,size(config_texture)), source=0.0_pReal)
allocate(texture_Fiber (6,texture_maxNfiber,size(config_texture)), source=0.0_pReal)
allocate(texture_transformation(3,3,size(config_texture)), source=0.0_pReal)
texture_transformation = spread(math_I3,3,size(config_texture))
do t=1_pInt, material_Ntexture
do t=1_pInt, size(config_texture)
section = t
gauss = 0_pInt
fiber = 0_pInt
if (textureConfig(t)%keyExists('axes')) then
strings = textureConfig(t)%getStrings('axes')
if (config_texture(t)%keyExists('axes')) then
strings = config_texture(t)%getStrings('axes')
do j = 1_pInt, 3_pInt ! look for "x", "y", and "z" entries
select case (strings(j))
case('x', '+x')
@ -959,10 +981,10 @@ subroutine material_parseTexture
endif
tag=''
texture_ODFfile(t) = textureConfig(t)%getString('hybridia',defaultVal=tag)
texture_ODFfile(t) = config_texture(t)%getString('hybridia',defaultVal=tag)
if (textureConfig(t)%keyExists('symmetry')) then
select case (textureConfig(t)%getString('symmetry'))
if (config_texture(t)%keyExists('symmetry')) then
select case (config_texture(t)%getString('symmetry'))
case('orthotropic')
texture_symmetry(t) = 4_pInt
case('monoclinic')
@ -972,8 +994,8 @@ subroutine material_parseTexture
end select
endif
if (textureConfig(t)%keyExists('(random)')) then
strings = textureConfig(t)%getStrings('(random)',raw=.true.)
if (config_texture(t)%keyExists('(random)')) then
strings = config_texture(t)%getStrings('(random)',raw=.true.)
do i = 1_pInt, size(strings)
gauss = gauss + 1_pInt
texture_Gauss(1:3,gauss,t) = math_sampleRandomOri()
@ -990,9 +1012,9 @@ subroutine material_parseTexture
endif
if (textureConfig(t)%keyExists('(gauss)')) then
if (config_texture(t)%keyExists('(gauss)')) then
gauss = gauss + 1_pInt
strings = textureConfig(t)%getStrings('(gauss)',raw= .true.)
strings = config_texture(t)%getStrings('(gauss)',raw= .true.)
do i = 1_pInt , size(strings)
chunkPos = IO_stringPos(strings(i))
do j = 1_pInt,9_pInt,2_pInt
@ -1013,9 +1035,9 @@ subroutine material_parseTexture
endif
if (textureConfig(t)%keyExists('(fiber)')) then
if (config_texture(t)%keyExists('(fiber)')) then
fiber = fiber + 1_pInt
strings = textureConfig(t)%getStrings('(fiber)',raw= .true.)
strings = config_texture(t)%getStrings('(fiber)',raw= .true.)
do i = 1_pInt, size(strings)
chunkPos = IO_stringPos(strings(i))
do j = 1_pInt,11_pInt,2_pInt
@ -1037,7 +1059,8 @@ subroutine material_parseTexture
enddo
endif
enddo
call config_deallocate('material.config/texture')
end subroutine material_parseTexture
@ -1066,6 +1089,11 @@ subroutine material_populateGrains
mesh_ipVolume, &
FE_Nips, &
FE_geomtype
use config, only: &
config_homogenization, &
config_microstructure, &
homogenization_name, &
microstructure_name
use IO, only: &
IO_error, &
IO_hybridIA
@ -1102,8 +1130,8 @@ subroutine material_populateGrains
allocate(material_texture(homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems), source=0_pInt)
allocate(material_EulerAngles(3,homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems),source=0.0_pReal)
allocate(Ngrains(material_Nhomogenization,material_Nmicrostructure), source=0_pInt)
allocate(Nelems(material_Nhomogenization,material_Nmicrostructure), source=0_pInt)
allocate(Ngrains(size(config_homogenization),size(config_microstructure)), source=0_pInt)
allocate(Nelems (size(config_homogenization),size(config_microstructure)), source=0_pInt)
! populating homogenization schemes in each
!--------------------------------------------------------------------------------------------------
@ -1118,9 +1146,9 @@ subroutine material_populateGrains
micro = mesh_element(4,e)
Nelems(homog,micro) = Nelems(homog,micro) + 1_pInt
enddo
allocate(elemsOfHomogMicro(material_Nhomogenization,material_Nmicrostructure))
do homog = 1,material_Nhomogenization
do micro = 1,material_Nmicrostructure
allocate(elemsOfHomogMicro(size(config_homogenization),size(config_microstructure)))
do homog = 1,size(config_homogenization)
do micro = 1,size(config_microstructure)
if (Nelems(homog,micro) > 0_pInt) then
allocate(elemsOfHomogMicro(homog,micro)%p(Nelems(homog,micro)))
elemsOfHomogMicro(homog,micro)%p = 0_pInt
@ -1135,9 +1163,9 @@ subroutine material_populateGrains
t = FE_geomtype(mesh_element(2,e))
homog = mesh_element(3,e)
micro = mesh_element(4,e)
if (homog < 1_pInt .or. homog > material_Nhomogenization) & ! out of bounds
if (homog < 1_pInt .or. homog > size(config_homogenization)) & ! out of bounds
call IO_error(154_pInt,e,0_pInt,0_pInt)
if (micro < 1_pInt .or. micro > material_Nmicrostructure) & ! out of bounds
if (micro < 1_pInt .or. micro > size(config_microstructure)) & ! out of bounds
call IO_error(155_pInt,e,0_pInt,0_pInt)
if (microstructure_elemhomo(micro)) then ! how many grains are needed at this element?
dGrains = homogenization_Ngrains(homog) ! only one set of Ngrains (other IPs are plain copies)
@ -1158,9 +1186,9 @@ subroutine material_populateGrains
write(6,'(/,a/)') ' MATERIAL grain population'
write(6,'(a32,1x,a32,1x,a6)') 'homogenization_name','microstructure_name','grain#'
endif
homogenizationLoop: do homog = 1_pInt,material_Nhomogenization
homogenizationLoop: do homog = 1_pInt,size(config_homogenization)
dGrains = homogenization_Ngrains(homog) ! grain number per material point
microstructureLoop: do micro = 1_pInt,material_Nmicrostructure ! all pairs of homog and micro
microstructureLoop: do micro = 1_pInt,size(config_microstructure) ! all pairs of homog and micro
activePair: if (Ngrains(homog,micro) > 0_pInt) then
myNgrains = Ngrains(homog,micro) ! assign short name for total number of grains to populate
myNconstituents = microstructure_Nconstituents(micro) ! assign short name for number of constituents

View File

@ -100,7 +100,7 @@ use IO
plasticState
use config, only: &
MATERIAL_partPhase, &
phaseConfig
config_phase
use lattice
@ -145,29 +145,29 @@ use IO
if (phase_plasticity(phase) == PLASTICITY_ISOTROPIC_ID) then
instance = phase_plasticityInstance(phase)
prm => param(instance) ! shorthand pointer to parameter object of my constitutive law
prm%tau0 = phaseConfig(phase)%getFloat('tau0')
prm%tausat = phaseConfig(phase)%getFloat('tausat')
prm%gdot0 = phaseConfig(phase)%getFloat('gdot0')
prm%n = phaseConfig(phase)%getFloat('n')
prm%h0 = phaseConfig(phase)%getFloat('h0')
prm%fTaylor = phaseConfig(phase)%getFloat('m')
prm%h0_slopeLnRate = phaseConfig(phase)%getFloat('h0_slopelnrate', defaultVal=0.0_pReal)
prm%tausat_SinhFitA = phaseConfig(phase)%getFloat('tausat_sinhfita',defaultVal=0.0_pReal)
prm%tausat_SinhFitB = phaseConfig(phase)%getFloat('tausat_sinhfitb',defaultVal=0.0_pReal)
prm%tausat_SinhFitC = phaseConfig(phase)%getFloat('tausat_sinhfitc',defaultVal=0.0_pReal)
prm%tausat_SinhFitD = phaseConfig(phase)%getFloat('tausat_sinhfitd',defaultVal=0.0_pReal)
prm%a = phaseConfig(phase)%getFloat('a')
prm%aTolFlowStress = phaseConfig(phase)%getFloat('atol_flowstress',defaultVal=1.0_pReal)
prm%aTolShear = phaseConfig(phase)%getFloat('atol_shear',defaultVal=1.0e-6_pReal)
prm%tau0 = config_phase(phase)%getFloat('tau0')
prm%tausat = config_phase(phase)%getFloat('tausat')
prm%gdot0 = config_phase(phase)%getFloat('gdot0')
prm%n = config_phase(phase)%getFloat('n')
prm%h0 = config_phase(phase)%getFloat('h0')
prm%fTaylor = config_phase(phase)%getFloat('m')
prm%h0_slopeLnRate = config_phase(phase)%getFloat('h0_slopelnrate', defaultVal=0.0_pReal)
prm%tausat_SinhFitA = config_phase(phase)%getFloat('tausat_sinhfita',defaultVal=0.0_pReal)
prm%tausat_SinhFitB = config_phase(phase)%getFloat('tausat_sinhfitb',defaultVal=0.0_pReal)
prm%tausat_SinhFitC = config_phase(phase)%getFloat('tausat_sinhfitc',defaultVal=0.0_pReal)
prm%tausat_SinhFitD = config_phase(phase)%getFloat('tausat_sinhfitd',defaultVal=0.0_pReal)
prm%a = config_phase(phase)%getFloat('a')
prm%aTolFlowStress = config_phase(phase)%getFloat('atol_flowstress',defaultVal=1.0_pReal)
prm%aTolShear = config_phase(phase)%getFloat('atol_shear',defaultVal=1.0e-6_pReal)
prm%dilatation = phaseConfig(phase)%keyExists('/dilatation/')
prm%dilatation = config_phase(phase)%keyExists('/dilatation/')
#if defined(__GFORTRAN__)
outputs = ['GfortranBug86277']
outputs = phaseConfig(phase)%getStrings('(output)',defaultVal=outputs)
outputs = config_phase(phase)%getStrings('(output)',defaultVal=outputs)
if (outputs(1) == 'GfortranBug86277') outputs = [character(len=65536)::]
#else
outputs = phaseConfig(phase)%getStrings('(output)',defaultVal=[character(len=65536)::])
outputs = config_phase(phase)%getStrings('(output)',defaultVal=[character(len=65536)::])
#endif
allocate(prm%outputID(0))
do i=1_pInt, size(outputs)