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DAMASK_EICMD
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Merge branch '30_parsePhasePartOnce' into development 

Changes have been reviewed by Philip, just waited for all tests to pass.
Failing tests were partly related to version mismatches on the test
server for Compiler, python etc.
This commit is contained in:
Martin Diehl 2018-06-28 12:37:40 +02:00
parent 1ae9f79ab4 b3862ef800
commit 5e5f975bff
54 changed files with 1614 additions and 1178 deletions
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25
.gitlab-ci.yml
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@ -7,7 +7,7 @@ stages:
- compileSpectralGNU
- prepareSpectral
- spectral
- compileMarc2016
- compileMarc2017
- marc
- compileAbaqus2016
- compileAbaqus2017
@ -69,13 +69,10 @@ variables:
# ++++++++++++ FEM +++++++++++++++++++++++++++++++++++++++++++++++++++
Abaqus2016: "FEM/Abaqus/2016"
Abaqus2017: "FEM/Abaqus/2017"
MSC2014: "FEM/MSC/2014"
MSC2014_2: "FEM/MSC/2014.2"
MSC2015: "FEM/MSC/2015"
MSC2016: "FEM/MSC/2016"
MSC2017: "FEM/MSC/2017"
# ------------ Defaults ----------------------------------------------
Abaqus: "$Abaqus2017"
MSC: "$MSC2016"
MSC: "$MSC2017"
# ++++++++++++ Documentation +++++++++++++++++++++++++++++++++++++++++
Doxygen1_8_13: "Documentation/Doxygen/1.8.13"
# ------------ Defaults ----------------------------------------------
@ -330,11 +327,11 @@ TextureComponents:
###################################################################################################
Marc_compileIfort2016:
stage: compileMarc2016
Marc_compileIfort2017:
stage: compileMarc2017
script:
- module load $IntelCompiler16_0 $MSC2016
- Marc_compileIfort/test.py -m 2016
- module load $IntelCompiler17_0 $MSC2017
- Marc_compileIfort/test.py -m 2017
except:
- master
- release
@ -343,7 +340,7 @@ Marc_compileIfort2016:
Hex_elastic:
stage: marc
script:
- module load $IntelCompiler16_0 $MSC
- module load $IntelCompiler17_0 $MSC
- Hex_elastic/test.py
except:
- master
@ -352,7 +349,7 @@ Hex_elastic:
CubicFCC_elastic:
stage: marc
script:
- module load $IntelCompiler16_0 $MSC
- module load $IntelCompiler17_0 $MSC
- CubicFCC_elastic/test.py
except:
- master
@ -361,7 +358,7 @@ CubicFCC_elastic:
CubicBCC_elastic:
stage: marc
script:
- module load $IntelCompiler16_0 $MSC
- module load $IntelCompiler17_0 $MSC
- CubicBCC_elastic/test.py
except:
- master
@ -370,7 +367,7 @@ CubicBCC_elastic:
J2_plasticBehavior:
stage: marc
script:
- module load $IntelCompiler16_0 $MSC
- module load $IntelCompiler17_0 $MSC
- J2_plasticBehavior/test.py
except:
- master

2
CONFIG
View File

@ -6,6 +6,6 @@ set DAMASK_BIN = ${DAMASK_ROOT}/bin
set DAMASK_NUM_THREADS = 4
set MSC_ROOT = /opt/msc
set MARC_VERSION = 2016
set MARC_VERSION = 2017
set ABAQUS_VERSION = 2017

2
PRIVATE

@ -1 +1 @@
Subproject commit cd02f6c1a481491eb4517651516b8311348b4777
Subproject commit aead92902b3a0cf3404be9c552bfec918d7aaffb

2
examples/SpectralMethod/Polycrystal/material.config
View File

@ -3,7 +3,7 @@
#-------------------#
[SX]
type none
mech none
#-------------------#
<crystallite>

4
lib/damask/solver/marc.py
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@ -9,10 +9,8 @@ class Marc(Solver):
def __init__(self):
self.solver = 'Marc'
self.releases = { \
'2017': ['linux64',''],
'2016': ['linux64',''],
'2015': ['linux64',''],
'2014.2':['linux64',''],
'2014' :['linux64',''],
}

9
src/CMakeLists.txt
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@ -15,7 +15,6 @@ add_dependencies(SYSTEM_ROUTINES C_ROUTINES)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:SYSTEM_ROUTINES>)
add_library(PREC OBJECT "prec.f90")
add_dependencies(PREC SYSTEM_ROUTINES)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:PREC>)
if (PROJECT_NAME STREQUAL "DAMASK_spectral")
@ -25,7 +24,7 @@ elseif (PROJECT_NAME STREQUAL "DAMASK_FEM")
else ()
message (FATAL_ERROR "Build target (PROJECT_NAME) is not defined")
endif()
add_dependencies(DAMASK_INTERFACE PREC)
add_dependencies(DAMASK_INTERFACE PREC SYSTEM_ROUTINES)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:DAMASK_INTERFACE>)
add_library(IO OBJECT "IO.f90")
@ -40,6 +39,10 @@ add_library(DEBUG OBJECT "debug.f90")
add_dependencies(DEBUG NUMERICS)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:DEBUG>)
add_library(CONFIG OBJECT "config.f90")
add_dependencies(CONFIG DEBUG)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:CONFIG>)
add_library(FEsolving OBJECT "FEsolving.f90")
add_dependencies(FEsolving DEBUG)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:FEsolving>)
@ -63,7 +66,7 @@ elseif (PROJECT_NAME STREQUAL "DAMASK_FEM")
endif()
add_library(MATERIAL OBJECT "material.f90")
add_dependencies(MATERIAL MESH)
add_dependencies(MATERIAL MESH CONFIG)
list(APPEND OBJECTFILES $<TARGET_OBJECTS:MATERIAL>)
add_library(DAMASK_HELPERS OBJECT "lattice.f90")

13
src/CPFEM.f90
View File

@ -62,16 +62,18 @@ subroutine CPFEM_initAll(el,ip)
numerics_init
use debug, only: &
debug_init
use config, only: &
config_init
use FEsolving, only: &
FE_init
use math, only: &
math_init
use mesh, only: &
mesh_init
use lattice, only: &
lattice_init
use material, only: &
material_init
use lattice, only: &
lattice_init
use constitutive, only: &
constitutive_init
use crystallite, only: &
@ -93,6 +95,7 @@ subroutine CPFEM_initAll(el,ip)
call IO_init
call numerics_init
call debug_init
call config_init
call math_init
call FE_init
call mesh_init(ip, el) ! pass on coordinates to alter calcMode of first ip
@ -143,7 +146,8 @@ subroutine CPFEM_init
material_phase, &
homogState, &
phase_plasticity, &
plasticState, &
plasticState
use config, only: &
material_Nhomogenization
use crystallite, only: &
crystallite_F0, &
@ -310,7 +314,8 @@ subroutine CPFEM_general(mode, parallelExecution, ffn, ffn1, temperature_inp, dt
thermal_type, &
THERMAL_conduction_ID, &
phase_Nsources, &
material_homog, &
material_homog
use config, only: &
material_Nhomogenization
use crystallite, only: &
crystallite_partionedF,&

13
src/CPFEM2.f90
View File

@ -27,16 +27,18 @@ subroutine CPFEM_initAll(el,ip)
numerics_init
use debug, only: &
debug_init
use config, only: &
config_init
use FEsolving, only: &
FE_init
use math, only: &
math_init
use mesh, only: &
mesh_init
use lattice, only: &
lattice_init
use material, only: &
material_init
use lattice, only: &
lattice_init
use constitutive, only: &
constitutive_init
use crystallite, only: &
@ -64,6 +66,7 @@ subroutine CPFEM_initAll(el,ip)
#endif
call numerics_init
call debug_init
call config_init
call math_init
call FE_init
call mesh_init(ip, el) ! pass on coordinates to alter calcMode of first ip
@ -108,7 +111,8 @@ subroutine CPFEM_init
material_phase, &
homogState, &
phase_plasticity, &
plasticState, &
plasticState
use config, only: &
material_Nhomogenization
use crystallite, only: &
crystallite_F0, &
@ -228,7 +232,8 @@ subroutine CPFEM_age()
hydrogenfluxState, &
material_phase, &
phase_plasticity, &
phase_Nsources, &
phase_Nsources
use config, only: &
material_Nhomogenization
use crystallite, only: &
crystallite_partionedF,&

1
src/DAMASK_marc2015.f90
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@ -1 +0,0 @@
DAMASK_marc.f90

46
src/IO.f90
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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):670–678, 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):670–678, 2008'
write(6,'(a)') ' https://doi.org/10.1016/j.commatsci.2007.09.015'
!--------------------------------------------------------------------------------------------------
@ -900,10 +900,10 @@ function IO_spotTagInPart(fileUnit,part,tag,Nsections)
do while (trim(line) /= IO_EOF)
line = IO_read(fileUnit)
if (IO_isBlank(line)) cycle ! skip empty lines
if (IO_getTag(line,'<','>') /= '') then ! stop at next part
foundNextPart: if (IO_getTag(line,'<','>') /= '') then
line = IO_read(fileUnit, .true.) ! reset IO_read
exit
endif
endif foundNextPart
if (IO_getTag(line,'[',']') /= '') section = section + 1_pInt ! found [section] identifier
if (section > 0_pInt) then
chunkPos = IO_stringPos(line)
@ -925,13 +925,10 @@ logical function IO_globalTagInPart(fileUnit,part,tag)
character(len=*),intent(in) :: part, & !< part in which tag is searched for
tag !< tag to search for
integer(pInt), allocatable, dimension(:) :: chunkPos
integer(pInt) :: section
character(len=65536) :: line
IO_globalTagInPart = .false. ! assume to nowhere spot tag
section = 0_pInt
line =''
rewind(fileUnit)
@ -942,16 +939,20 @@ logical function IO_globalTagInPart(fileUnit,part,tag)
do while (trim(line) /= IO_EOF)
line = IO_read(fileUnit)
if (IO_isBlank(line)) cycle ! skip empty lines
if (IO_getTag(line,'<','>') /= '') then ! stop at next part
foundNextPart: if (IO_getTag(line,'<','>') /= '') then
line = IO_read(fileUnit, .true.) ! reset IO_read
exit
endif
if (IO_getTag(line,'[',']') /= '') section = section + 1_pInt ! found [section] identifier
if (section == 0_pInt) then
chunkPos = IO_stringPos(line)
if (tag == trim(IO_lc(IO_stringValue(line,chunkPos,1_pInt)))) & ! match
IO_globalTagInPart = .true.
endif
endif foundNextPart
foundFirstSection: if (IO_getTag(line,'[',']') /= '') then
line = IO_read(fileUnit, .true.) ! reset IO_read
exit
endif foundFirstSection
chunkPos = IO_stringPos(line)
match: if (tag == trim(IO_lc(IO_stringValue(line,chunkPos,1_pInt)))) then
IO_globalTagInPart = .true.
line = IO_read(fileUnit, .true.) ! reset IO_read
exit
endif match
enddo
end function IO_globalTagInPart
@ -981,6 +982,10 @@ pure function IO_stringPos(string)
if ( string(left:left) == '#' ) exit
IO_stringPos = [IO_stringPos,int(left, pInt), int(right, pInt)]
IO_stringPos(1) = IO_stringPos(1)+1_pInt
endOfString: if (right < left) then
IO_stringPos(IO_stringPos(1)*2+1) = len_trim(string)
exit
endif endOfString
enddo
end function IO_stringPos
@ -1545,6 +1550,17 @@ subroutine IO_error(error_ID,el,ip,g,instance,ext_msg)
case (136_pInt)
msg = 'zero entry on stiffness diagonal for transformed phase'
!--------------------------------------------------------------------------------------------------
! errors related to the parsing of material.config
case (140_pInt)
msg = 'key not found'
case (141_pInt)
msg = 'number of chunks in string differs'
case (142_pInt)
msg = 'empty list'
case (143_pInt)
msg = 'no value found for key'
!--------------------------------------------------------------------------------------------------
! material error messages and related messages in mesh
case (150_pInt)

1
src/commercialFEM_fileList.f90
View File

@ -6,6 +6,7 @@
#include "IO.f90"
#include "numerics.f90"
#include "debug.f90"
#include "config.f90"
#include "math.f90"
#include "FEsolving.f90"
#include "mesh.f90"

692
src/config.f90 Normal file
View File

@ -0,0 +1,692 @@
!--------------------------------------------------------------------------------------------------
!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
!> @brief Reads in the material configuration from file
!> @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
!! parts 'homogenization', 'crystallite', 'phase', 'texture', and 'microstucture'
!--------------------------------------------------------------------------------------------------
module config
use prec, only: &
pReal, &
pInt
implicit none
private
type, private :: tPartitionedString
character(len=:), allocatable :: val
integer(pInt), dimension(:), allocatable :: pos
end type tPartitionedString
type, public :: tPartitionedStringList
type(tPartitionedString) :: string
type(tPartitionedStringList), pointer :: next => null()
contains
procedure :: add => add
procedure :: show => show
procedure :: free => free
procedure :: keyExists => keyExists
procedure :: countKeys => countKeys
procedure :: getFloat => getFloat
procedure :: getInt => getInt
procedure :: getString => getString
procedure :: getFloats => getFloats
procedure :: getInts => getInts
procedure :: getStrings => getStrings
end type tPartitionedStringList
type(tPartitionedStringList), public :: emptyList
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
homogenization_name, & !< name of each homogenization
crystallite_name, & !< name of each crystallite setting
microstructure_name, & !< name of each microstructure
texture_name !< name of each texture
! ToDo: make private, no one needs to know that
character(len=*), parameter, public :: &
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
character(len=*), parameter, private :: &
MATERIAL_partTexture = 'texture' !< keyword for texture part
! ToDo: Remove, use size(config_phase) etc
integer(pInt), public, protected :: &
material_Nphase, & !< number of phases
material_Nhomogenization, & !< number of homogenizations
material_Nmicrostructure, & !< number of microstructures
material_Ncrystallite !< number of crystallite settings
! ToDo: make private, no one needs to know that
character(len=*), parameter, public :: &
MATERIAL_configFile = 'material.config', & !< generic name for material configuration file
MATERIAL_localFileExt = 'materialConfig' !< extension of solver job name depending material configuration file
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: &
compiler_version, &
compiler_options
#endif
use IO, only: &
IO_error, &
IO_open_file, &
IO_read, &
IO_lc, &
IO_open_jobFile_stat, &
IO_getTag, &
IO_timeStamp, &
IO_EOF
use debug, only: &
debug_level, &
debug_material, &
debug_levelBasic
implicit none
integer(pInt), parameter :: FILEUNIT = 200_pInt
integer(pInt) :: myDebug
character(len=65536) :: &
line, &
part
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
rewind(fileUnit)
line = '' ! to have it initialized
do while (trim(line) /= IO_EOF)
part = IO_lc(IO_getTag(line,'<','>'))
select case (trim(part))
case (trim(material_partPhase))
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,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,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,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,config_texture,FILEUNIT)
if (iand(myDebug,debug_levelBasic) /= 0_pInt) write(6,'(a)') ' Texture parsed'; flush(6)
case default
line = IO_read(fileUnit)
end select
enddo
material_Nhomogenization = size(config_homogenization)
if (material_Nhomogenization < 1_pInt) call IO_error(160_pInt,ext_msg=material_partHomogenization)
material_Nmicrostructure = size(config_microstructure)
if (material_Nmicrostructure < 1_pInt) call IO_error(160_pInt,ext_msg=material_partMicrostructure)
material_Ncrystallite = size(config_crystallite)
if (material_Ncrystallite < 1_pInt) call IO_error(160_pInt,ext_msg=material_partCrystallite)
material_Nphase = size(config_phase)
if (material_Nphase < 1_pInt) call IO_error(160_pInt,ext_msg=material_partPhase)
if (size(config_texture) < 1_pInt) call IO_error(160_pInt,ext_msg=material_partTexture)
end subroutine config_init
!--------------------------------------------------------------------------------------------------
!> @brief parses the material.config file
!--------------------------------------------------------------------------------------------------
subroutine parseFile(line,&
sectionNames,part,fileUnit)
use IO, only: &
IO_read, &
IO_error, &
IO_lc, &
IO_getTag, &
IO_isBlank, &
IO_stringValue, &
IO_stringPos, &
IO_EOF
implicit none
integer(pInt), intent(in) :: fileUnit
character(len=*), dimension(:), allocatable, intent(inout) :: sectionNames
type(tPartitionedStringList), allocatable, dimension(:), intent(inout) :: part
character(len=65536),intent(out) :: line
integer(pInt), allocatable, dimension(:) :: chunkPos
integer(pInt) :: s
character(len=65536) :: devNull
character(len=64) :: tag
logical :: echo
echo = .false.
allocate(part(0))
s = 0_pInt
do while (trim(line) /= IO_EOF) ! read through sections of material part
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 to close any recursively included files
exit
endif foundNextPart
nextSection: if (IO_getTag(line,'[',']') /= '') then
s = s + 1_pInt
part = [part, emptyList]
tag = IO_getTag(line,'[',']')
GfortranBug86033: if (.not. allocated(sectionNames)) then
allocate(sectionNames(1),source=tag)
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
inSection: if (s > 0_pInt) then
call part(s)%add(IO_lc(trim(line)))
else inSection
echo = (trim(tag) == '/echo/')
endif inSection
enddo
if (echo) then
do s = 1, size(sectionNames)
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
!! element is added at the end of the list. Empty strings are not added. All strings are converted
!! to lower case
!--------------------------------------------------------------------------------------------------
subroutine add(this,string)
use IO, only: &
IO_isBlank, &
IO_lc, &
IO_stringPos
implicit none
class(tPartitionedStringList), target, intent(in) :: this
character(len=*), intent(in) :: string
type(tPartitionedStringList), pointer :: new, item
if (IO_isBlank(string)) return
allocate(new)
new%string%val = IO_lc (trim(string))
new%string%pos = IO_stringPos(trim(string))
item => this
do while (associated(item%next))
item => item%next
enddo
item%next => new
end subroutine add
!--------------------------------------------------------------------------------------------------
!> @brief prints all elements
!> @details Strings are printed in order of insertion (FIFO)
!--------------------------------------------------------------------------------------------------
subroutine show(this)
implicit none
class(tPartitionedStringList) :: this
type(tPartitionedStringList), pointer :: item
item => this%next
do while (associated(item))
write(6,'(a)') trim(item%string%val)
item => item%next
end do
end subroutine show
!--------------------------------------------------------------------------------------------------
!> @brief cleans entire list
!> @details list head is remains alive
!--------------------------------------------------------------------------------------------------
subroutine free(this)
implicit none
class(tPartitionedStringList), target, intent(in) :: this
type(tPartitionedStringList), pointer :: new, item
if (.not. associated(this%next)) return
item => this%next
do while (associated(item%next))
new => item
deallocate(item)
item => new%next
enddo
deallocate(item)
end subroutine free
!--------------------------------------------------------------------------------------------------
!> @brief reports wether a given key (string value at first position) exists in the list
!--------------------------------------------------------------------------------------------------
logical function keyExists(this,key)
use IO, only: &
IO_stringValue
implicit none
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
type(tPartitionedStringList), pointer :: item
keyExists = .false.
item => this%next
do while (associated(item) .and. .not. keyExists)
keyExists = trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)
item => item%next
end do
end function keyExists
!--------------------------------------------------------------------------------------------------
!> @brief count number of key appearances
!> @details traverses list and counts each occurrence of specified key
!--------------------------------------------------------------------------------------------------
integer(pInt) function countKeys(this,key)
use IO, only: &
IO_stringValue
implicit none
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
type(tPartitionedStringList), pointer :: item
countKeys = 0_pInt
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) &
countKeys = countKeys + 1_pInt
item => item%next
end do
end function countKeys
!--------------------------------------------------------------------------------------------------
!> @brief gets float value of for a given key from a linked list
!> @details gets the last value if the key occurs more than once. If key is not found exits with
!! error unless default is given
!--------------------------------------------------------------------------------------------------
real(pReal) function getFloat(this,key,defaultVal)
use IO, only : &
IO_error, &
IO_stringValue, &
IO_FloatValue
implicit none
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
real(pReal), intent(in), optional :: defaultVal
type(tPartitionedStringList), pointer :: item
logical :: found
found = present(defaultVal)
if (found) getFloat = defaultVal
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
getFloat = IO_FloatValue(item%string%val,item%string%pos,2)
endif
item => item%next
end do
if (.not. found) call IO_error(140_pInt,ext_msg=key)
end function getFloat
!--------------------------------------------------------------------------------------------------
!> @brief gets integer value of for a given key from a linked list
!> @details gets the last value if the key occurs more than once. If key is not found exits with
!! error unless default is given
!--------------------------------------------------------------------------------------------------
integer(pInt) function getInt(this,key,defaultVal)
use IO, only: &
IO_error, &
IO_stringValue, &
IO_IntValue
implicit none
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
integer(pInt), intent(in), optional :: defaultVal
type(tPartitionedStringList), pointer :: item
logical :: found
found = present(defaultVal)
if (found) getInt = defaultVal
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
getInt = IO_IntValue(item%string%val,item%string%pos,2)
endif
item => item%next
end do
if (.not. found) call IO_error(140_pInt,ext_msg=key)
end function getInt
!--------------------------------------------------------------------------------------------------
!> @brief gets string value of for a given key from a linked list
!> @details gets the last value if the key occurs more than once. If key is not found exits with
!! error unless default is given. If raw is true, the the complete string is returned, otherwise
!! the individual chunks are returned
!--------------------------------------------------------------------------------------------------
character(len=65536) function getString(this,key,defaultVal,raw)
use IO, only: &
IO_error, &
IO_stringValue
implicit none
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
character(len=65536), intent(in), optional :: defaultVal
logical, intent(in), optional :: raw
type(tPartitionedStringList), pointer :: item
logical :: found, &
whole
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))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
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)
end function getString
!--------------------------------------------------------------------------------------------------
!> @brief gets array of float values of for a given key from a linked list
!> @details for cumulative keys, "()", values from all occurrences are return. Otherwise only all
!! values from the last occurrence. If key is not found exits with error unless default is given.
!--------------------------------------------------------------------------------------------------
function getFloats(this,key,defaultVal,requiredShape)
use IO, only: &
IO_error, &
IO_stringValue, &
IO_FloatValue
implicit none
real(pReal), dimension(:), allocatable :: getFloats
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
real(pReal), dimension(:), intent(in), optional :: defaultVal
integer(pInt), dimension(:), intent(in), optional :: requiredShape
type(tPartitionedStringList), pointer :: item
integer(pInt) :: i
logical :: found, &
cumulative
cumulative = (key(1:1) == '(' .and. key(len_trim(key):len_trim(key)) == ')')
found = .false.
allocate(getFloats(0))
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
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)]
enddo
endif
item => item%next
end do
if (.not. found) then
if (present(defaultVal)) then; getFloats = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
end function getFloats
!--------------------------------------------------------------------------------------------------
!> @brief gets array of integer values of for a given key from a linked list
!> @details for cumulative keys, "()", values from all occurrences are return. Otherwise only all
!! values from the last occurrence. If key is not found exits with error unless default is given.
!--------------------------------------------------------------------------------------------------
function getInts(this,key,defaultVal,requiredShape)
use IO, only: &
IO_error, &
IO_stringValue, &
IO_IntValue
implicit none
integer(pInt), dimension(:), allocatable :: getInts
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
integer(pInt), dimension(:), intent(in), optional :: defaultVal, &
requiredShape
type(tPartitionedStringList), pointer :: item
integer(pInt) :: i
logical :: found, &
cumulative
cumulative = (key(1:1) == '(' .and. key(len_trim(key):len_trim(key)) == ')')
found = .false.
allocate(getInts(0))
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
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)]
enddo
endif
item => item%next
end do
if (.not. found) then
if (present(defaultVal)) then; getInts = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
end function getInts
!--------------------------------------------------------------------------------------------------
!> @brief gets array of string values of for a given key from a linked list
!> @details for cumulative keys, "()", values from all occurrences are return. Otherwise only all
!! values from the last occurrence. If key is not found exits with error unless default is given.
!! If raw is true, the the complete string is returned, otherwise the individual chunks are returned
!--------------------------------------------------------------------------------------------------
function getStrings(this,key,defaultVal,requiredShape,raw)
use IO, only: &
IO_error, &
IO_StringValue
implicit none
character(len=65536),dimension(:), allocatable :: getStrings
class(tPartitionedStringList), intent(in) :: this
character(len=*), intent(in) :: key
character(len=65536),dimension(:), intent(in), optional :: defaultVal
integer(pInt), dimension(:), intent(in), optional :: requiredShape
logical, intent(in), optional :: raw
type(tPartitionedStringList), pointer :: item
character(len=65536) :: str
integer(pInt) :: i
logical :: found, &
whole, &
cumulative
cumulative = (key(1:1) == '(' .and. key(len_trim(key):len_trim(key)) == ')')
whole = merge(raw,.false.,present(raw))
found = .false.
item => this%next
do while (associated(item))
if (trim(IO_stringValue(item%string%val,item%string%pos,1)) == trim(key)) then
found = .true.
if (allocated(getStrings) .and. .not. cumulative) deallocate(getStrings)
if (item%string%pos(1) < 2_pInt) call IO_error(143_pInt,ext_msg=key)
notAllocated: if (.not. allocated(getStrings)) 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
endif
else notAllocated
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
endif
endif notAllocated
endif
item => item%next
end do
if (.not. found) then
if (present(defaultVal)) then; getStrings = defaultVal; else; call IO_error(140_pInt,ext_msg=key); endif
endif
end function getStrings
end module config

64
src/constitutive.f90
View File

@ -57,14 +57,17 @@ subroutine constitutive_init()
IO_write_jobFile, &
IO_write_jobIntFile, &
IO_timeStamp
use config, only: &
config_deallocate
use mesh, only: &
FE_geomtype
use material, only: &
material_phase, &
use config, only: &
material_Nphase, &
material_localFileExt, &
material_configFile, &
phase_name, &
material_configFile
use material, only: &
material_phase, &
phase_plasticity, &
phase_plasticityInstance, &
phase_Nsources, &
@ -143,7 +146,6 @@ subroutine constitutive_init()
ins !< instance of plasticity/source
integer(pInt), dimension(:,:), pointer :: thisSize
integer(pInt), dimension(:) , pointer :: thisNoutput
character(len=64), dimension(:,:), pointer :: thisOutput
character(len=32) :: outputName !< name of output, intermediate fix until HDF5 output is ready
logical :: knownPlasticity, knownSource, nonlocalConstitutionPresent
@ -157,7 +159,7 @@ subroutine constitutive_init()
!--------------------------------------------------------------------------------------------------
! parse plasticities from config file
if (any(phase_plasticity == PLASTICITY_NONE_ID)) call plastic_none_init
if (any(phase_plasticity == PLASTICITY_ISOTROPIC_ID)) call plastic_isotropic_init(FILEUNIT)
if (any(phase_plasticity == PLASTICITY_ISOTROPIC_ID)) call plastic_isotropic_init
if (any(phase_plasticity == PLASTICITY_PHENOPOWERLAW_ID)) call plastic_phenopowerlaw_init(FILEUNIT)
if (any(phase_plasticity == PLASTICITY_KINEHARDENING_ID)) call plastic_kinehardening_init(FILEUNIT)
if (any(phase_plasticity == PLASTICITY_DISLOTWIN_ID)) call plastic_dislotwin_init(FILEUNIT)
@ -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"
@ -205,37 +209,30 @@ subroutine constitutive_init()
plasticityType: select case(phase_plasticity(p))
case (PLASTICITY_NONE_ID) plasticityType
outputName = PLASTICITY_NONE_label
thisNoutput => null()
thisOutput => null()
thisSize => null()
case (PLASTICITY_ISOTROPIC_ID) plasticityType
outputName = PLASTICITY_ISOTROPIC_label
thisNoutput => plastic_isotropic_Noutput
thisOutput => plastic_isotropic_output
thisSize => plastic_isotropic_sizePostResult
case (PLASTICITY_PHENOPOWERLAW_ID) plasticityType
outputName = PLASTICITY_PHENOPOWERLAW_label
thisNoutput => plastic_phenopowerlaw_Noutput
thisOutput => plastic_phenopowerlaw_output
thisSize => plastic_phenopowerlaw_sizePostResult
case (PLASTICITY_KINEHARDENING_ID) plasticityType
outputName = PLASTICITY_KINEHARDENING_label
thisNoutput => plastic_kinehardening_Noutput
thisOutput => plastic_kinehardening_output
thisSize => plastic_kinehardening_sizePostResult
case (PLASTICITY_DISLOTWIN_ID) plasticityType
outputName = PLASTICITY_DISLOTWIN_label
thisNoutput => plastic_dislotwin_Noutput
thisOutput => plastic_dislotwin_output
thisSize => plastic_dislotwin_sizePostResult
case (PLASTICITY_DISLOUCLA_ID) plasticityType
outputName = PLASTICITY_DISLOUCLA_label
thisNoutput => plastic_disloucla_Noutput
thisOutput => plastic_disloucla_output
thisSize => plastic_disloucla_sizePostResult
case (PLASTICITY_NONLOCAL_ID) plasticityType
outputName = PLASTICITY_NONLOCAL_label
thisNoutput => plastic_nonlocal_Noutput
thisOutput => plastic_nonlocal_output
thisSize => plastic_nonlocal_sizePostResult
case default plasticityType
@ -246,8 +243,9 @@ subroutine constitutive_init()
write(FILEUNIT,'(a)') '(plasticity)'//char(9)//trim(outputName)
if (phase_plasticity(p) /= PLASTICITY_NONE_ID) then
OutputPlasticityLoop: do o = 1_pInt,thisNoutput(ins)
write(FILEUNIT,'(a,i4)') trim(thisOutput(o,ins))//char(9),thisSize(o,ins)
OutputPlasticityLoop: do o = 1_pInt,size(thisOutput(:,ins))
if(len(trim(thisOutput(o,ins))) > 0_pInt) &
write(FILEUNIT,'(a,i4)') trim(thisOutput(o,ins))//char(9),thisSize(o,ins)
enddo OutputPlasticityLoop
endif
endif
@ -257,55 +255,46 @@ subroutine constitutive_init()
case (SOURCE_thermal_dissipation_ID) sourceType
ins = source_thermal_dissipation_instance(p)
outputName = SOURCE_thermal_dissipation_label
thisNoutput => source_thermal_dissipation_Noutput
thisOutput => source_thermal_dissipation_output
thisSize => source_thermal_dissipation_sizePostResult
case (SOURCE_thermal_externalheat_ID) sourceType
ins = source_thermal_externalheat_instance(p)
outputName = SOURCE_thermal_externalheat_label
thisNoutput => source_thermal_externalheat_Noutput
thisOutput => source_thermal_externalheat_output
thisSize => source_thermal_externalheat_sizePostResult
case (SOURCE_damage_isoBrittle_ID) sourceType
ins = source_damage_isoBrittle_instance(p)
outputName = SOURCE_damage_isoBrittle_label
thisNoutput => source_damage_isoBrittle_Noutput
thisOutput => source_damage_isoBrittle_output
thisSize => source_damage_isoBrittle_sizePostResult
case (SOURCE_damage_isoDuctile_ID) sourceType
ins = source_damage_isoDuctile_instance(p)
outputName = SOURCE_damage_isoDuctile_label
thisNoutput => source_damage_isoDuctile_Noutput
thisOutput => source_damage_isoDuctile_output
thisSize => source_damage_isoDuctile_sizePostResult
case (SOURCE_damage_anisoBrittle_ID) sourceType
ins = source_damage_anisoBrittle_instance(p)
outputName = SOURCE_damage_anisoBrittle_label
thisNoutput => source_damage_anisoBrittle_Noutput
thisOutput => source_damage_anisoBrittle_output
thisSize => source_damage_anisoBrittle_sizePostResult
case (SOURCE_damage_anisoDuctile_ID) sourceType
ins = source_damage_anisoDuctile_instance(p)
outputName = SOURCE_damage_anisoDuctile_label
thisNoutput => source_damage_anisoDuctile_Noutput
thisOutput => source_damage_anisoDuctile_output
thisSize => source_damage_anisoDuctile_sizePostResult
case (SOURCE_vacancy_phenoplasticity_ID) sourceType
ins = source_vacancy_phenoplasticity_instance(p)
outputName = SOURCE_vacancy_phenoplasticity_label
thisNoutput => source_vacancy_phenoplasticity_Noutput
thisOutput => source_vacancy_phenoplasticity_output
thisSize => source_vacancy_phenoplasticity_sizePostResult
case (SOURCE_vacancy_irradiation_ID) sourceType
ins = source_vacancy_irradiation_instance(p)
outputName = SOURCE_vacancy_irradiation_label
thisNoutput => source_vacancy_irradiation_Noutput
thisOutput => source_vacancy_irradiation_output
thisSize => source_vacancy_irradiation_sizePostResult
case (SOURCE_vacancy_thermalfluc_ID) sourceType
ins = source_vacancy_thermalfluc_instance(p)
outputName = SOURCE_vacancy_thermalfluc_label
thisNoutput => source_vacancy_thermalfluc_Noutput
thisOutput => source_vacancy_thermalfluc_output
thisSize => source_vacancy_thermalfluc_sizePostResult
case default sourceType
@ -313,8 +302,9 @@ subroutine constitutive_init()
end select sourceType
if (knownSource) then
write(FILEUNIT,'(a)') '(source)'//char(9)//trim(outputName)
OutputSourceLoop: do o = 1_pInt,thisNoutput(ins)
write(FILEUNIT,'(a,i4)') trim(thisOutput(o,ins))//char(9),thisSize(o,ins)
OutputSourceLoop: do o = 1_pInt,size(thisOutput(:,ins))
if(len(trim(thisOutput(o,ins))) > 0_pInt) &
write(FILEUNIT,'(a,i4)') trim(thisOutput(o,ins))//char(9),thisSize(o,ins)
enddo OutputSourceLoop
endif
enddo SourceLoop
@ -350,30 +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

234
src/crystallite.f90
View File

@ -155,7 +155,6 @@ subroutine crystallite_init
math_I3, &
math_EulerToR, &
math_inv33, &
math_transpose33, &
math_mul33xx33, &
math_mul33x33
use FEsolving, only: &
@ -167,28 +166,22 @@ subroutine crystallite_init
mesh_maxNips, &
mesh_maxNipNeighbors
use IO, only: &
IO_read, &
IO_timeStamp, &
IO_open_jobFile_stat, &
IO_open_file, &
IO_lc, &
IO_getTag, &
IO_isBlank, &
IO_stringPos, &
IO_stringValue, &
IO_write_jobFile, &
IO_error, &
IO_EOF
IO_error
use material
use config, only: &
config_crystallite, &
crystallite_name, &
config_deallocate
use constitutive, only: &
constitutive_initialFi, &
constitutive_microstructure ! derived (shortcut) quantities of given state
implicit none
integer(pInt), parameter :: &
FILEUNIT = 200_pInt
integer(pInt), allocatable, dimension(:) :: chunkPos
integer(pInt), parameter :: FILEUNIT=434_pInt
integer(pInt) :: &
c, & !< counter in integration point component loop
i, & !< counter in integration point loop
@ -200,12 +193,11 @@ subroutine crystallite_init
eMax, & !< maximum number of elements
nMax, & !< maximum number of ip neighbors
myNcomponents, & !< number of components at current IP
section = 0_pInt, &
mySize
character(len=65536), dimension(:), allocatable :: str
character(len=65536) :: &
tag = '', &
line= ''
tag = ''
write(6,'(/,a)') ' <<<+- crystallite init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
@ -270,94 +262,77 @@ 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)
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
do while (trim(line) /= IO_EOF .and. IO_lc(IO_getTag(line,'<','>')) /= material_partCrystallite) ! wind forward to <crystallite>
line = IO_read(FILEUNIT)
enddo
do while (trim(line) /= IO_EOF) ! read through sections of crystallite part
line = IO_read(FILEUNIT)
if (IO_isBlank(line)) cycle ! skip empty lines
if (IO_getTag(line,'<','>') /= '') then ! stop at next part
line = IO_read(FILEUNIT, .true.) ! reset IO_read
exit
endif
if (IO_getTag(line,'[',']') /= '') then ! next section
section = section + 1_pInt
o = 0_pInt ! reset output counter
cycle ! skip to next line
endif
if (section > 0_pInt) then
chunkPos = IO_stringPos(line)
tag = IO_lc(IO_stringValue(line,chunkPos,1_pInt)) ! extract key
select case(tag)
case ('(output)')
o = o + 1_pInt
crystallite_output(o,section) = IO_lc(IO_stringValue(line,chunkPos,2_pInt))
outputName: select case(crystallite_output(o,section))
do c = 1_pInt, size(config_crystallite)
#if defined(__GFORTRAN__)
str = ['GfortranBug86277']
str = config_crystallite(c)%getStrings('(output)',defaultVal=str)
if (str(1) == 'GfortranBug86277') str = [character(len=65536)::]
#else
str = config_crystallite(c)%getStrings('(output)',defaultVal=[character(len=65536)::])
#endif
do o = 1_pInt, size(str)
crystallite_output(o,c) = str(o)
outputName: select case(str(o))
case ('phase') outputName
crystallite_outputID(o,section) = phase_ID
crystallite_outputID(o,c) = phase_ID
case ('texture') outputName
crystallite_outputID(o,section) = texture_ID
crystallite_outputID(o,c) = texture_ID
case ('volume') outputName
crystallite_outputID(o,section) = volume_ID
crystallite_outputID(o,c) = volume_ID
case ('grainrotationx') outputName
crystallite_outputID(o,section) = grainrotationx_ID
crystallite_outputID(o,c) = grainrotationx_ID
case ('grainrotationy') outputName
crystallite_outputID(o,section) = grainrotationy_ID
crystallite_outputID(o,c) = grainrotationy_ID
case ('grainrotationz') outputName
crystallite_outputID(o,section) = grainrotationx_ID
crystallite_outputID(o,c) = grainrotationx_ID
case ('orientation') outputName
crystallite_outputID(o,section) = orientation_ID
crystallite_outputID(o,c) = orientation_ID
case ('grainrotation') outputName
crystallite_outputID(o,section) = grainrotation_ID
crystallite_outputID(o,c) = grainrotation_ID
case ('eulerangles') outputName
crystallite_outputID(o,section) = eulerangles_ID
crystallite_outputID(o,c) = eulerangles_ID
case ('defgrad','f') outputName
crystallite_outputID(o,section) = defgrad_ID
crystallite_outputID(o,c) = defgrad_ID
case ('fe') outputName
crystallite_outputID(o,section) = fe_ID
crystallite_outputID(o,c) = fe_ID
case ('fp') outputName
crystallite_outputID(o,section) = fp_ID
crystallite_outputID(o,c) = fp_ID
case ('fi') outputName
crystallite_outputID(o,section) = fi_ID
crystallite_outputID(o,c) = fi_ID
case ('lp') outputName
crystallite_outputID(o,section) = lp_ID
crystallite_outputID(o,c) = lp_ID
case ('li') outputName
crystallite_outputID(o,section) = li_ID
crystallite_outputID(o,c) = li_ID
case ('e') outputName
crystallite_outputID(o,section) = e_ID
crystallite_outputID(o,c) = e_ID
case ('ee') outputName
crystallite_outputID(o,section) = ee_ID
crystallite_outputID(o,c) = ee_ID
case ('p','firstpiola','1stpiola') outputName
crystallite_outputID(o,section) = p_ID
crystallite_outputID(o,c) = p_ID
case ('s','tstar','secondpiola','2ndpiola') outputName
crystallite_outputID(o,section) = s_ID
crystallite_outputID(o,c) = s_ID
case ('elasmatrix') outputName
crystallite_outputID(o,section) = elasmatrix_ID
crystallite_outputID(o,c) = elasmatrix_ID
case ('neighboringip') outputName
crystallite_outputID(o,section) = neighboringip_ID
crystallite_outputID(o,c) = neighboringip_ID
case ('neighboringelement') outputName
crystallite_outputID(o,section) = neighboringelement_ID
crystallite_outputID(o,c) = neighboringelement_ID
case default outputName
call IO_error(105_pInt,ext_msg=IO_stringValue(line,chunkPos,2_pInt)//' (Crystallite)')
call IO_error(105_pInt,ext_msg=tag//' (Crystallite)')
end select outputName
end select
endif
enddo
enddo
close(FILEUNIT)
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)
@ -382,14 +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)
@ -401,6 +376,8 @@ subroutine crystallite_init
close(FILEUNIT)
endif
call config_deallocate('material.config/crystallite')
!--------------------------------------------------------------------------------------------------
! initialize
!$OMP PARALLEL DO PRIVATE(myNcomponents)
@ -537,7 +514,6 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
use math, only: &
math_inv33, &
math_identity2nd, &
math_transpose33, &
math_mul33x33, &
math_mul66x6, &
math_Mandel6to33, &
@ -616,17 +592,17 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
write(6,'(/,a,i8,1x,a,i8,a,1x,i2,1x,i3)') '<< CRYST >> boundary values at el ip ipc ', &
debug_e,'(',mesh_element(1,debug_e), ')',debug_i, debug_g
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> F ', &
math_transpose33(crystallite_partionedF(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedF(1:3,1:3,debug_g,debug_i,debug_e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> F0 ', &
math_transpose33(crystallite_partionedF0(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedF0(1:3,1:3,debug_g,debug_i,debug_e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Fp0', &
math_transpose33(crystallite_partionedFp0(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedFp0(1:3,1:3,debug_g,debug_i,debug_e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Fi0', &
math_transpose33(crystallite_partionedFi0(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedFi0(1:3,1:3,debug_g,debug_i,debug_e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Lp0', &
math_transpose33(crystallite_partionedLp0(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedLp0(1:3,1:3,debug_g,debug_i,debug_e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Li0', &
math_transpose33(crystallite_partionedLi0(1:3,1:3,debug_g,debug_i,debug_e))
transpose(crystallite_partionedLi0(1:3,1:3,debug_g,debug_i,debug_e))
endif
!--------------------------------------------------------------------------------------------------
@ -1107,15 +1083,15 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
.or. .not. iand(debug_level(debug_crystallite),debug_levelSelective) /= 0_pInt)) then
write(6,'(a,i8,1x,i2,1x,i3)') '<< CRYST >> central solution of cryst_StressAndTangent at el ip ipc ',e,i,c
write(6,'(/,a,/,3(12x,3(f12.4,1x)/))') '<< CRYST >> P / MPa', &
math_transpose33(crystallite_P(1:3,1:3,c,i,e))*1.0e-6_pReal
transpose(crystallite_P(1:3,1:3,c,i,e))*1.0e-6_pReal
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Fp', &
math_transpose33(crystallite_Fp(1:3,1:3,c,i,e))
transpose(crystallite_Fp(1:3,1:3,c,i,e))
write(6,'(a,/,3(12x,3(f14.9,1x)/))') '<< CRYST >> Fi', &
math_transpose33(crystallite_Fi(1:3,1:3,c,i,e))
transpose(crystallite_Fi(1:3,1:3,c,i,e))
write(6,'(a,/,3(12x,3(f14.9,1x)/),/)') '<< CRYST >> Lp', &
math_transpose33(crystallite_Lp(1:3,1:3,c,i,e))
transpose(crystallite_Lp(1:3,1:3,c,i,e))
write(6,'(a,/,3(12x,3(f14.9,1x)/),/)') '<< CRYST >> Li', &
math_transpose33(crystallite_Li(1:3,1:3,c,i,e))
transpose(crystallite_Li(1:3,1:3,c,i,e))
flush(6)
endif
enddo
@ -1166,7 +1142,7 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
crystallite_Fi(1:3,1:3,c,i,e),c,i,e) ! call constitutive law to calculate Lp tangent in lattice configuration
dLpdS = math_mul3333xx3333(dLpdFi,dFidS) + dLpdS
temp_33 = math_transpose33(math_mul33x33(crystallite_invFp(1:3,1:3,c,i,e), &
temp_33 = transpose(math_mul33x33(crystallite_invFp(1:3,1:3,c,i,e), &
crystallite_invFi(1:3,1:3,c,i,e)))
rhs_3333 = 0.0_pReal
forall(p=1_pInt:3_pInt, o=1_pInt:3_pInt) &
@ -1208,12 +1184,12 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
crystallite_dPdF(1:3,1:3,1:3,1:3,c,i,e) = 0.0_pReal
temp_33 = math_mul33x33(crystallite_invFp(1:3,1:3,c,i,e), &
math_mul33x33(math_Mandel6to33(crystallite_Tstar_v(1:6,c,i,e)), &
math_transpose33(crystallite_invFp(1:3,1:3,c,i,e))))
transpose(crystallite_invFp(1:3,1:3,c,i,e))))
forall(p=1_pInt:3_pInt) &
crystallite_dPdF(p,1:3,p,1:3,c,i,e) = math_transpose33(temp_33)
crystallite_dPdF(p,1:3,p,1:3,c,i,e) = transpose(temp_33)
temp_33 = math_mul33x33(math_Mandel6to33(crystallite_Tstar_v(1:6,c,i,e)), &
math_transpose33(crystallite_invFp(1:3,1:3,c,i,e)))
transpose(crystallite_invFp(1:3,1:3,c,i,e)))
forall(p=1_pInt:3_pInt, o=1_pInt:3_pInt) &
crystallite_dPdF(1:3,1:3,p,o,c,i,e) = crystallite_dPdF(1:3,1:3,p,o,c,i,e) + &
math_mul33x33(math_mul33x33(crystallite_subF(1:3,1:3,c,i,e),dFpinvdF(1:3,1:3,p,o)),temp_33)
@ -1223,14 +1199,14 @@ subroutine crystallite_stressAndItsTangent(updateJaco)
forall(p=1_pInt:3_pInt, o=1_pInt:3_pInt) &
crystallite_dPdF(1:3,1:3,p,o,c,i,e) = crystallite_dPdF(1:3,1:3,p,o,c,i,e) + &
math_mul33x33(math_mul33x33(temp_33,dSdF(1:3,1:3,p,o)), &
math_transpose33(crystallite_invFp(1:3,1:3,c,i,e)))
transpose(crystallite_invFp(1:3,1:3,c,i,e)))
temp_33 = math_mul33x33(math_mul33x33(crystallite_subF(1:3,1:3,c,i,e), &
crystallite_invFp(1:3,1:3,c,i,e)), &
math_Mandel6to33(crystallite_Tstar_v(1:6,c,i,e)))
forall(p=1_pInt:3_pInt, o=1_pInt:3_pInt) &
crystallite_dPdF(1:3,1:3,p,o,c,i,e) = crystallite_dPdF(1:3,1:3,p,o,c,i,e) + &
math_mul33x33(temp_33,math_transpose33(dFpinvdF(1:3,1:3,p,o)))
math_mul33x33(temp_33,transpose(dFpinvdF(1:3,1:3,p,o)))
enddo; enddo
enddo elementLooping6
@ -1272,8 +1248,9 @@ subroutine crystallite_integrateStateRK4()
plasticState, &
sourceState, &
phase_Nsources, &
material_Nphase, &
phaseAt, phasememberAt
use config, only: &
material_Nphase
use constitutive, only: &
constitutive_collectDotState, &
constitutive_microstructure
@ -3195,7 +3172,6 @@ function crystallite_push33ToRef(ipc,ip,el, tensor33)
use math, only: &
math_mul33x33, &
math_inv33, &
math_transpose33, &
math_EulerToR
use material, only: &
material_EulerAngles
@ -3210,8 +3186,8 @@ function crystallite_push33ToRef(ipc,ip,el, tensor33)
ipc ! grain index
T = math_mul33x33(math_EulerToR(material_EulerAngles(1:3,ipc,ip,el)), &
math_transpose33(math_inv33(crystallite_subF(1:3,1:3,ipc,ip,el))))
crystallite_push33ToRef = math_mul33x33(math_transpose33(T),math_mul33x33(tensor33,T))
transpose(math_inv33(crystallite_subF(1:3,1:3,ipc,ip,el))))
crystallite_push33ToRef = math_mul33x33(transpose(T),math_mul33x33(tensor33,T))
end function crystallite_push33ToRef
@ -3260,7 +3236,6 @@ logical function crystallite_integrateStress(&
math_mul3333xx3333, &
math_mul66x6, &
math_mul99x99, &
math_transpose33, &
math_inv33, &
math_invert, &
math_det33, &
@ -3386,7 +3361,7 @@ logical function crystallite_integrateStress(&
write(6,'(a,i8,1x,a,i8,a,1x,i2,1x,i3)') '<< CRYST >> integrateStress failed on inversion of Fp_current at el (elFE) ip ipc ',&
el,'(',mesh_element(1,el),')',ip,ipc
if (iand(debug_level(debug_crystallite), debug_levelExtensive) > 0_pInt) &
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp_current',math_transpose33(Fp_current(1:3,1:3))
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp_current',transpose(Fp_current(1:3,1:3))
endif
#endif
return
@ -3402,7 +3377,7 @@ logical function crystallite_integrateStress(&
write(6,'(a,i8,1x,a,i8,a,1x,i2,1x,i3)') '<< CRYST >> integrateStress failed on inversion of Fi_current at el (elFE) ip ipc ',&
el,'(',mesh_element(1,el),')',ip,ipc
if (iand(debug_level(debug_crystallite), debug_levelExtensive) > 0_pInt) &
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp_current',math_transpose33(Fi_current(1:3,1:3))
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp_current',transpose(Fi_current(1:3,1:3))
endif
#endif
return
@ -3465,9 +3440,9 @@ logical function crystallite_integrateStress(&
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then
write(6,'(a,i3,/)') '<< CRYST >> stress iteration ', NiterationStressLp
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Lpguess', math_transpose33(Lpguess)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Fi', math_transpose33(Fi_new)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Fe', math_transpose33(Fe)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Lpguess', transpose(Lpguess)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Fi', transpose(Fi_new)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Fe', transpose(Fe)
write(6,'(a,/,6(e20.10,1x))') '<< CRYST >> Tstar', Tstar_v
endif
#endif
@ -3488,7 +3463,7 @@ logical function crystallite_integrateStress(&
if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt &
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Lp_constitutive', math_transpose33(Lp_constitutive)
write(6,'(a,/,3(12x,3(e20.10,1x)/))') '<< CRYST >> Lp_constitutive', transpose(Lp_constitutive)
endif
#endif
@ -3534,7 +3509,7 @@ logical function crystallite_integrateStress(&
if (mod(jacoCounterLp, iJacoLpresiduum) == 0_pInt) then
dFe_dLp3333 = 0.0_pReal
forall(o=1_pInt:3_pInt,p=1_pInt:3_pInt) &
dFe_dLp3333(o,1:3,p,1:3) = A(o,p)*math_transpose33(invFi_new) ! dFe_dLp(i,j,k,l) = -dt * A(i,k) invFi(l,j)
dFe_dLp3333(o,1:3,p,1:3) = A(o,p)*transpose(invFi_new) ! dFe_dLp(i,j,k,l) = -dt * A(i,k) invFi(l,j)
dFe_dLp3333 = - dt * dFe_dLp3333
dRLp_dLp = math_identity2nd(9_pInt) &
- math_Plain3333to99(math_mul3333xx3333(math_mul3333xx3333(dLp_dT3333,dT_dFe3333),dFe_dLp3333))
@ -3564,10 +3539,10 @@ logical function crystallite_integrateStress(&
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dFe_dLp',transpose(math_Plain3333to99(dFe_dLp3333))
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dT_dFe_constitutive',transpose(math_Plain3333to99(dT_dFe3333))
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dLp_dT_constitutive',transpose(math_Plain3333to99(dLp_dT3333))
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> A',math_transpose33(A)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> B',math_transpose33(B)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Lp_constitutive',math_transpose33(Lp_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Lpguess',math_transpose33(Lpguess)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> A',transpose(A)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> B',transpose(B)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Lp_constitutive',transpose(Lp_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Lpguess',transpose(Lpguess)
endif
endif
#endif
@ -3597,8 +3572,8 @@ logical function crystallite_integrateStress(&
if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt &
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Li_constitutive', math_transpose33(Li_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Liguess', math_transpose33(Liguess)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Li_constitutive', transpose(Li_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Liguess', transpose(Liguess)
endif
#endif
!* update current residuum and check for convergence of loop
@ -3653,8 +3628,8 @@ logical function crystallite_integrateStress(&
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dFe_dLi',transpose(math_Plain3333to99(dFe_dLi3333))
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dT_dFi_constitutive',transpose(math_Plain3333to99(dT_dFi3333))
write(6,'(a,/,9(12x,9(e15.3,1x)/))') '<< CRYST >> dLi_dT_constitutive',transpose(math_Plain3333to99(dLi_dT3333))
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Li_constitutive',math_transpose33(Li_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Liguess',math_transpose33(Liguess)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Li_constitutive',transpose(Li_constitutive)
write(6,'(a,/,3(12x,3(e20.7,1x)/))') '<< CRYST >> Liguess',transpose(Liguess)
endif
endif
#endif
@ -3688,7 +3663,7 @@ logical function crystallite_integrateStress(&
if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt &
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) &
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> invFp_new',math_transpose33(invFp_new)
write(6,'(/,a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> invFp_new',transpose(invFp_new)
endif
#endif
return
@ -3699,7 +3674,7 @@ logical function crystallite_integrateStress(&
crystallite_P(1:3,1:3,ipc,ip,el) = math_mul33x33(math_mul33x33(Fg_new,invFp_new), &
math_mul33x33(math_Mandel6to33(Tstar_v), &
math_transpose33(invFp_new)))
transpose(invFp_new)))
!* store local values in global variables
@ -3719,13 +3694,13 @@ logical function crystallite_integrateStress(&
if (iand(debug_level(debug_crystallite),debug_levelExtensive) /= 0_pInt &
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> P / MPa',math_transpose33(crystallite_P(1:3,1:3,ipc,ip,el))*1.0e-6_pReal
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> P / MPa',transpose(crystallite_P(1:3,1:3,ipc,ip,el))*1.0e-6_pReal
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Cauchy / MPa', &
math_mul33x33(crystallite_P(1:3,1:3,ipc,ip,el), math_transpose33(Fg_new)) * 1.0e-6_pReal / math_det33(Fg_new)
math_mul33x33(crystallite_P(1:3,1:3,ipc,ip,el), transpose(Fg_new)) * 1.0e-6_pReal / math_det33(Fg_new)
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fe Lp Fe^-1', &
math_transpose33(math_mul33x33(Fe_new, math_mul33x33(crystallite_Lp(1:3,1:3,ipc,ip,el), math_inv33(Fe_new)))) ! transpose to get correct print out order
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp',math_transpose33(crystallite_Fp(1:3,1:3,ipc,ip,el))
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fi',math_transpose33(crystallite_Fi(1:3,1:3,ipc,ip,el))
transpose(math_mul33x33(Fe_new, math_mul33x33(crystallite_Lp(1:3,1:3,ipc,ip,el), math_inv33(Fe_new)))) ! transpose to get correct print out order
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fp',transpose(crystallite_Fp(1:3,1:3,ipc,ip,el))
write(6,'(a,/,3(12x,3(f12.7,1x)/))') '<< CRYST >> Fi',transpose(crystallite_Fi(1:3,1:3,ipc,ip,el))
endif
#endif
@ -3842,7 +3817,6 @@ function crystallite_postResults(ipc, ip, el)
math_qToEuler, &
math_qToEulerAxisAngle, &
math_mul33x33, &
math_transpose33, &
math_det33, &
math_I3, &
inDeg, &
@ -3945,41 +3919,41 @@ function crystallite_postResults(ipc, ip, el)
case (defgrad_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_partionedF(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_partionedF(1:3,1:3,ipc,ip,el)),[mySize])
case (e_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = 0.5_pReal * reshape((math_mul33x33( &
math_transpose33(crystallite_partionedF(1:3,1:3,ipc,ip,el)), &
transpose(crystallite_partionedF(1:3,1:3,ipc,ip,el)), &
crystallite_partionedF(1:3,1:3,ipc,ip,el)) - math_I3),[mySize])
case (fe_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_Fe(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_Fe(1:3,1:3,ipc,ip,el)),[mySize])
case (ee_ID)
Ee = 0.5_pReal *(math_mul33x33(math_transpose33(crystallite_Fe(1:3,1:3,ipc,ip,el)), &
Ee = 0.5_pReal *(math_mul33x33(transpose(crystallite_Fe(1:3,1:3,ipc,ip,el)), &
crystallite_Fe(1:3,1:3,ipc,ip,el)) - math_I3)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = reshape(Ee,[mySize])
case (fp_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_Fp(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_Fp(1:3,1:3,ipc,ip,el)),[mySize])
case (fi_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_Fi(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_Fi(1:3,1:3,ipc,ip,el)),[mySize])
case (lp_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_Lp(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_Lp(1:3,1:3,ipc,ip,el)),[mySize])
case (li_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_Li(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_Li(1:3,1:3,ipc,ip,el)),[mySize])
case (p_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &
reshape(math_transpose33(crystallite_P(1:3,1:3,ipc,ip,el)),[mySize])
reshape(transpose(crystallite_P(1:3,1:3,ipc,ip,el)),[mySize])
case (s_ID)
mySize = 9_pInt
crystallite_postResults(c+1:c+mySize) = &

3
src/damage_local.f90
View File

@ -70,7 +70,8 @@ subroutine damage_local_init(fileUnit)
damageState, &
damageMapping, &
damage, &
damage_initialPhi, &
damage_initialPhi
use config, only: &
material_partHomogenization
implicit none

1
src/damage_none.f90
View File

@ -26,6 +26,7 @@ subroutine damage_none_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &

3
src/damage_nonlocal.f90
View File

@ -75,7 +75,8 @@ subroutine damage_nonlocal_init(fileUnit)
damageState, &
damageMapping, &
damage, &
damage_initialPhi, &
damage_initialPhi
use config, only: &
material_partHomogenization
implicit none

20
src/homogenization.f90
View File

@ -100,6 +100,12 @@ 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 homogenization_none
use homogenization_isostrain
@ -196,7 +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
@ -369,6 +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)
@ -394,7 +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)
@ -443,11 +451,9 @@ subroutine homogenization_init
allocate(materialpoint_results(materialpoint_sizeResults,mesh_maxNips,mesh_NcpElems))
#endif
mainProcess: if (worldrank == 0) then
write(6,'(/,a)') ' <<<+- homogenization init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
write(6,'(/,a)') ' <<<+- homogenization init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
#include "compilation_info.f90"
endif mainProcess
if (iand(debug_level(debug_homogenization), debug_levelBasic) /= 0_pInt) then
#ifdef TODO
@ -475,7 +481,7 @@ subroutine homogenization_init
flush(6)
if (debug_g < 1 .or. debug_g > homogenization_Ngrains(mesh_element(3,debug_e))) &
call IO_error(602_pInt,ext_msg='component (grain)', el=debug_e, g=debug_g)
call IO_error(602_pInt,ext_msg='constituent', el=debug_e, g=debug_g)
end subroutine homogenization_init

1
src/homogenization_RGC.f90
View File

@ -100,6 +100,7 @@ subroutine homogenization_RGC_init(fileUnit)
FE_geomtype
use IO
use material
use config
implicit none
integer(pInt), intent(in) :: fileUnit !< file pointer to material configuration

1
src/homogenization_isostrain.f90
View File

@ -62,6 +62,7 @@ subroutine homogenization_isostrain_init(fileUnit)
debug_levelBasic
use IO
use material
use config
implicit none
integer(pInt), intent(in) :: fileUnit

1
src/homogenization_none.f90
View File

@ -29,6 +29,7 @@ subroutine homogenization_none_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &

3
src/hydrogenflux_cahnhilliard.f90
View File

@ -81,7 +81,8 @@ subroutine hydrogenflux_cahnhilliard_init(fileUnit)
hydrogenfluxMapping, &
hydrogenConc, &
hydrogenConcRate, &
hydrogenflux_initialCh, &
hydrogenflux_initialCh
use config, only: &
material_partHomogenization, &
material_partPhase

1
src/hydrogenflux_isoconc.f90
View File

@ -27,6 +27,7 @@ subroutine hydrogenflux_isoconc_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &

3
src/kinematics_cleavage_opening.f90
View File

@ -78,7 +78,8 @@ subroutine kinematics_cleavage_opening_init(fileUnit)
phase_Nkinematics, &
phase_Noutput, &
KINEMATICS_cleavage_opening_label, &
KINEMATICS_cleavage_opening_ID, &
KINEMATICS_cleavage_opening_ID
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use lattice, only: &

3
src/kinematics_hydrogen_strain.f90
View File

@ -68,7 +68,8 @@ subroutine kinematics_hydrogen_strain_init(fileUnit)
phase_Nkinematics, &
phase_Noutput, &
KINEMATICS_hydrogen_strain_label, &
KINEMATICS_hydrogen_strain_ID, &
KINEMATICS_hydrogen_strain_ID
use config, only: &
material_Nphase, &
MATERIAL_partPhase

3
src/kinematics_slipplane_opening.f90
View File

@ -78,7 +78,8 @@ subroutine kinematics_slipplane_opening_init(fileUnit)
phase_Nkinematics, &
phase_Noutput, &
KINEMATICS_slipplane_opening_label, &
KINEMATICS_slipplane_opening_ID, &
KINEMATICS_slipplane_opening_ID
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use lattice, only: &

3
src/kinematics_thermal_expansion.f90
View File

@ -68,7 +68,8 @@ subroutine kinematics_thermal_expansion_init(fileUnit)
phase_Nkinematics, &
phase_Noutput, &
KINEMATICS_thermal_expansion_label, &
KINEMATICS_thermal_expansion_ID, &
KINEMATICS_thermal_expansion_ID
use config, only: &
material_Nphase, &
MATERIAL_partPhase

3
src/kinematics_vacancy_strain.f90
View File

@ -68,7 +68,8 @@ subroutine kinematics_vacancy_strain_init(fileUnit)
phase_Nkinematics, &
phase_Noutput, &
KINEMATICS_vacancy_strain_label, &
KINEMATICS_vacancy_strain_ID, &
KINEMATICS_vacancy_strain_ID
use config, only: &
material_Nphase, &
MATERIAL_partPhase

2
src/lattice.f90
View File

@ -1263,7 +1263,7 @@ subroutine lattice_init
IO_stringPos, &
IO_stringValue, &
IO_floatValue
use material, only: &
use config, only: &
material_configfile, &
material_localFileExt, &
material_partPhase

1199
src/material.f90
View File

File diff suppressed because it is too large Load Diff

1
src/math.f90
View File

@ -223,7 +223,6 @@ end subroutine math_init
!> @brief check correctness of (some) math functions
!--------------------------------------------------------------------------------------------------
subroutine math_check
use prec, only: tol_math_check
use IO, only: IO_error

5
src/plastic_disloUCLA.f90
View File

@ -151,8 +151,9 @@ subroutine plastic_disloUCLA_init(fileUnit)
phase_Noutput, &
PLASTICITY_DISLOUCLA_label, &
PLASTICITY_DISLOUCLA_ID, &
material_phase, &
plasticState, &
material_phase, &
plasticState
use config, only: &
MATERIAL_partPhase
use lattice
use numerics,only: &

3
src/plastic_dislotwin.f90
View File

@ -239,7 +239,8 @@ subroutine plastic_dislotwin_init(fileUnit)
PLASTICITY_DISLOTWIN_label, &
PLASTICITY_DISLOTWIN_ID, &
material_phase, &
plasticState, &
plasticState
use config, only: &
MATERIAL_partPhase
use lattice
use numerics,only: &

337
src/plastic_isotropic.f90
View File

@ -13,15 +13,10 @@ module plastic_isotropic
implicit none
private
integer(pInt), dimension(:), allocatable, public, protected :: &
plastic_isotropic_sizePostResults !< cumulative size of post results
integer(pInt), dimension(:,:), allocatable, target, public :: &
plastic_isotropic_sizePostResult !< size of each post result output
character(len=64), dimension(:,:), allocatable, target, public :: &
plastic_isotropic_output !< name of each post result output
integer(pInt), dimension(:), allocatable, target, public :: &
plastic_isotropic_Noutput !< number of outputs per instance
@ -40,17 +35,17 @@ module plastic_isotropic
gdot0, &
n, &
h0, &
h0_slopeLnRate = 0.0_pReal, &
h0_slopeLnRate, &
tausat, &
a, &
aTolFlowstress = 1.0_pReal, &
aTolShear = 1.0e-6_pReal, &
tausat_SinhFitA= 0.0_pReal, &
tausat_SinhFitB= 0.0_pReal, &
tausat_SinhFitC= 0.0_pReal, &
tausat_SinhFitD= 0.0_pReal
aTolFlowstress, &
aTolShear, &
tausat_SinhFitA, &
tausat_SinhFitB, &
tausat_SinhFitC, &
tausat_SinhFitD
logical :: &
dilatation = .false.
dilatation
end type
type(tParameters), dimension(:), allocatable, target, private :: param !< containers of constitutive parameters (len Ninstance)
@ -79,12 +74,13 @@ contains
!> @brief module initialization
!> @details reads in material parameters, allocates arrays, and does sanity checks
!--------------------------------------------------------------------------------------------------
subroutine plastic_isotropic_init(fileUnit)
subroutine plastic_isotropic_init()
#if defined(__GFORTRAN__) || __INTEL_COMPILER >= 1800
use, intrinsic :: iso_fortran_env, only: &
compiler_version, &
compiler_options
#endif
use IO
use debug, only: &
debug_level, &
debug_constitutive, &
@ -94,17 +90,6 @@ subroutine plastic_isotropic_init(fileUnit)
use math, only: &
math_Mandel3333to66, &
math_Voigt66to3333
use IO, only: &
IO_read, &
IO_lc, &
IO_getTag, &
IO_isBlank, &
IO_stringPos, &
IO_stringValue, &
IO_floatValue, &
IO_error, &
IO_timeStamp, &
IO_EOF
use material, only: &
phase_plasticity, &
phase_plasticityInstance, &
@ -112,17 +97,17 @@ subroutine plastic_isotropic_init(fileUnit)
PLASTICITY_ISOTROPIC_label, &
PLASTICITY_ISOTROPIC_ID, &
material_phase, &
plasticState, &
MATERIAL_partPhase
plasticState
use config, only: &
MATERIAL_partPhase, &
config_phase
use lattice
implicit none
integer(pInt), intent(in) :: fileUnit
type(tParameters), pointer :: p
type(tParameters), pointer :: prm
integer(pInt), allocatable, dimension(:) :: chunkPos
integer(pInt) :: &
o, &
phase, &
@ -133,174 +118,103 @@ subroutine plastic_isotropic_init(fileUnit)
sizeState, &
sizeDeltaState
character(len=65536) :: &
tag = '', &
line = '', &
extmsg = ''
character(len=64) :: &
outputtag = ''
integer(pInt) :: NipcMyPhase
integer(pInt) :: NipcMyPhase,i
character(len=65536), dimension(:), allocatable :: outputs
write(6,'(/,a)') ' <<<+- constitutive_'//PLASTICITY_ISOTROPIC_label//' init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
#include "compilation_info.f90"
maxNinstance = int(count(phase_plasticity == PLASTICITY_ISOTROPIC_ID),pInt)
if (maxNinstance == 0_pInt) return
if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0_pInt) &
write(6,'(a16,1x,i5,/)') '# instances:',maxNinstance
allocate(plastic_isotropic_sizePostResults(maxNinstance), source=0_pInt)
! public variables
allocate(plastic_isotropic_sizePostResult(maxval(phase_Noutput), maxNinstance),source=0_pInt)
allocate(plastic_isotropic_output(maxval(phase_Noutput), maxNinstance))
plastic_isotropic_output = ''
allocate(plastic_isotropic_Noutput(maxNinstance), source=0_pInt)
! inernal variable
allocate(param(maxNinstance)) ! one container of parameters per instance
rewind(fileUnit)
phase = 0_pInt
do while (trim(line) /= IO_EOF .and. IO_lc(IO_getTag(line,'<','>')) /= material_partPhase) ! wind forward to <phase>
line = IO_read(fileUnit)
enddo
parsingFile: do while (trim(line) /= IO_EOF) ! read through sections of phase part
line = IO_read(fileUnit)
if (IO_isBlank(line)) cycle ! skip empty lines
if (IO_getTag(line,'<','>') /= '') then ! stop at next part
line = IO_read(fileUnit, .true.) ! reset IO_read
exit
endif
if (IO_getTag(line,'[',']') /= '') then ! next section
phase = phase + 1_pInt ! advance section counter
cycle ! skip to next line
endif
if (phase > 0_pInt) then; if (phase_plasticity(phase) == PLASTICITY_ISOTROPIC_ID) then ! one of my phases. Do not short-circuit here (.and. between if-statements), it's not safe in Fortran
instance = phase_plasticityInstance(phase) ! which instance of my plasticity is present phase
p => param(instance) ! shorthand pointer to parameter object of my constitutive law
chunkPos = IO_stringPos(line)
tag = IO_lc(IO_stringValue(line,chunkPos,1_pInt)) ! extract key
select case(tag)
case ('(output)')
outputtag = IO_lc(IO_stringValue(line,chunkPos,2_pInt))
select case(outputtag)
case ('flowstress')
plastic_isotropic_Noutput(instance) = plastic_isotropic_Noutput(instance) + 1_pInt
plastic_isotropic_output(plastic_isotropic_Noutput(instance),instance) = outputtag
p%outputID = [p%outputID,flowstress_ID]
case ('strainrate')
plastic_isotropic_Noutput(instance) = plastic_isotropic_Noutput(instance) + 1_pInt
plastic_isotropic_output(plastic_isotropic_Noutput(instance),instance) = outputtag
p%outputID = [p%outputID,strainrate_ID]
end select
case ('/dilatation/')
p%dilatation = .true.
case ('tau0')
p%tau0 = IO_floatValue(line,chunkPos,2_pInt)
case ('gdot0')
p%gdot0 = IO_floatValue(line,chunkPos,2_pInt)
case ('n')
p%n = IO_floatValue(line,chunkPos,2_pInt)
case ('h0')
p%h0 = IO_floatValue(line,chunkPos,2_pInt)
case ('h0_slope','slopelnrate')
p%h0_slopeLnRate = IO_floatValue(line,chunkPos,2_pInt)
case ('tausat')
p%tausat = IO_floatValue(line,chunkPos,2_pInt)
case ('tausat_sinhfita')
p%tausat_SinhFitA = IO_floatValue(line,chunkPos,2_pInt)
case ('tausat_sinhfitb')
p%tausat_SinhFitB = IO_floatValue(line,chunkPos,2_pInt)
case ('tausat_sinhfitc')
p%tausat_SinhFitC = IO_floatValue(line,chunkPos,2_pInt)
case ('tausat_sinhfitd')
p%tausat_SinhFitD = IO_floatValue(line,chunkPos,2_pInt)
case ('a', 'w0')
p%a = IO_floatValue(line,chunkPos,2_pInt)
case ('taylorfactor')
p%fTaylor = IO_floatValue(line,chunkPos,2_pInt)
case ('atol_flowstress')
p%aTolFlowstress = IO_floatValue(line,chunkPos,2_pInt)
case ('atol_shear')
p%aTolShear = IO_floatValue(line,chunkPos,2_pInt)
case default
end select
endif; endif
enddo parsingFile
allocate(state(maxNinstance)) ! internal state aliases
allocate(dotState(maxNinstance))
initializeInstances: do phase = 1_pInt, size(phase_plasticity) ! loop over every plasticity
myPhase: if (phase_plasticity(phase) == PLASTICITY_isotropic_ID) then ! isolate instances of own constitutive description
NipcMyPhase = count(material_phase == phase) ! number of own material points (including point components ipc)
do phase = 1_pInt, size(phase_plasticityInstance)
if (phase_plasticity(phase) == PLASTICITY_ISOTROPIC_ID) then
instance = phase_plasticityInstance(phase)
p => param(instance)
extmsg = ''
prm => param(instance) ! shorthand pointer to parameter object of my constitutive law
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 = config_phase(phase)%keyExists('/dilatation/')
#if defined(__GFORTRAN__)
outputs = ['GfortranBug86277']
outputs = config_phase(phase)%getStrings('(output)',defaultVal=outputs)
if (outputs(1) == 'GfortranBug86277') outputs = [character(len=65536)::]
#else
outputs = config_phase(phase)%getStrings('(output)',defaultVal=[character(len=65536)::])
#endif
allocate(prm%outputID(0))
do i=1_pInt, size(outputs)
select case(outputs(i))
case ('flowstress')
plastic_isotropic_Noutput(instance) = plastic_isotropic_Noutput(instance) + 1_pInt
plastic_isotropic_output(plastic_isotropic_Noutput(instance),instance) = outputs(i)
plasticState(phase)%sizePostResults = plasticState(phase)%sizePostResults + 1_pInt
plastic_isotropic_sizePostResult(i,instance) = 1_pInt
prm%outputID = [prm%outputID,flowstress_ID]
case ('strainrate')
plastic_isotropic_Noutput(instance) = plastic_isotropic_Noutput(instance) + 1_pInt
plastic_isotropic_output(plastic_isotropic_Noutput(instance),instance) = outputs(i)
plasticState(phase)%sizePostResults = &
plasticState(phase)%sizePostResults + 1_pInt
plastic_isotropic_sizePostResult(i,instance) = 1_pInt
prm%outputID = [prm%outputID,strainrate_ID]
end select
enddo
!--------------------------------------------------------------------------------------------------
! sanity checks
if (p%aTolShear <= 0.0_pReal) p%aTolShear = 1.0e-6_pReal ! default absolute tolerance 1e-6
if (p%tau0 < 0.0_pReal) extmsg = trim(extmsg)//' tau0'
if (p%gdot0 <= 0.0_pReal) extmsg = trim(extmsg)//' gdot0'
if (p%n <= 0.0_pReal) extmsg = trim(extmsg)//' n'
if (p%tausat <= 0.0_pReal) extmsg = trim(extmsg)//' tausat'
if (p%a <= 0.0_pReal) extmsg = trim(extmsg)//' a'
if (p%fTaylor <= 0.0_pReal) extmsg = trim(extmsg)//' taylorfactor'
if (p%aTolFlowstress <= 0.0_pReal) extmsg = trim(extmsg)//' atol_flowstress'
if (extmsg /= '') then
extmsg = trim(extmsg)//' ('//PLASTICITY_ISOTROPIC_label//')' ! prepare error message identifier
call IO_error(211_pInt,ip=instance,ext_msg=extmsg)
endif
!--------------------------------------------------------------------------------------------------
! Determine size of postResults array
outputsLoop: do o = 1_pInt,plastic_isotropic_Noutput(instance)
select case(p%outputID(o))
case(flowstress_ID,strainrate_ID)
mySize = 1_pInt
case default
end select
outputFound: if (mySize > 0_pInt) then
plastic_isotropic_sizePostResult(o,instance) = mySize
plastic_isotropic_sizePostResults(instance) = &
plastic_isotropic_sizePostResults(instance) + mySize
endif outputFound
enddo outputsLoop
extmsg = ''
if (prm%aTolShear <= 0.0_pReal) extmsg = trim(extmsg)//"'aTolShear' "
if (prm%tau0 < 0.0_pReal) extmsg = trim(extmsg)//"'tau0' "
if (prm%gdot0 <= 0.0_pReal) extmsg = trim(extmsg)//"'gdot0' "
if (prm%n <= 0.0_pReal) extmsg = trim(extmsg)//"'n' "
if (prm%tausat <= prm%tau0) extmsg = trim(extmsg)//"'tausat' "
if (prm%a <= 0.0_pReal) extmsg = trim(extmsg)//"'a' "
if (prm%fTaylor <= 0.0_pReal) extmsg = trim(extmsg)//"'m' "
if (prm%aTolFlowstress <= 0.0_pReal) extmsg = trim(extmsg)//"'atol_flowstress' "
if (extmsg /= '') call IO_error(211_pInt,ip=instance,&
ext_msg=trim(extmsg)//'('//PLASTICITY_ISOTROPIC_label//')')
!--------------------------------------------------------------------------------------------------
! allocate state arrays
NipcMyPhase = count(material_phase == phase) ! number of own material points (including point components ipc)
sizeDotState = size(["flowstress ","accumulated_shear"])
sizeDeltaState = 0_pInt ! no sudden jumps in state
sizeState = sizeDotState + sizeDeltaState
plasticState(phase)%sizeState = sizeState
plasticState(phase)%sizeDotState = sizeDotState
plasticState(phase)%sizeDeltaState = sizeDeltaState
plasticState(phase)%sizePostResults = plastic_isotropic_sizePostResults(instance)
plasticState(phase)%nSlip = 1
plasticState(phase)%nTwin = 0
plasticState(phase)%nTrans= 0
allocate(plasticState(phase)%aTolState ( sizeState))
allocate(plasticState(phase)%state0 ( sizeState,NipcMyPhase),source=0.0_pReal)
allocate(plasticState(phase)%partionedState0 ( sizeState,NipcMyPhase),source=0.0_pReal)
allocate(plasticState(phase)%subState0 ( sizeState,NipcMyPhase),source=0.0_pReal)
allocate(plasticState(phase)%state ( sizeState,NipcMyPhase),source=0.0_pReal)
@ -320,22 +234,23 @@ subroutine plastic_isotropic_init(fileUnit)
state(instance)%flowstress => plasticState(phase)%state (1,1:NipcMyPhase)
dotState(instance)%flowstress => plasticState(phase)%dotState (1,1:NipcMyPhase)
plasticState(phase)%state0(1,1:NipcMyPhase) = p%tau0
plasticState(phase)%aTolState(1) = p%aTolFlowstress
plasticState(phase)%state0(1,1:NipcMyPhase) = prm%tau0
plasticState(phase)%aTolState(1) = prm%aTolFlowstress
state(instance)%accumulatedShear => plasticState(phase)%state (2,1:NipcMyPhase)
dotState(instance)%accumulatedShear => plasticState(phase)%dotState (2,1:NipcMyPhase)
plasticState(phase)%state0 (2,1:NipcMyPhase) = 0.0_pReal
plasticState(phase)%aTolState(2) = p%aTolShear
plasticState(phase)%aTolState(2) = prm%aTolShear
! global alias
plasticState(phase)%slipRate => plasticState(phase)%dotState(2:2,1:NipcMyPhase)
plasticState(phase)%accumulatedSlip => plasticState(phase)%state (2:2,1:NipcMyPhase)
endif myPhase
enddo initializeInstances
endif
enddo
end subroutine plastic_isotropic_init
!--------------------------------------------------------------------------------------------------
!> @brief calculates plastic velocity gradient and its tangent
!--------------------------------------------------------------------------------------------------
@ -354,8 +269,7 @@ subroutine plastic_isotropic_LpAndItsTangent(Lp,dLp_dTstar99,Tstar_v,ipc,ip,el)
math_Mandel6to33, &
math_Plain3333to99, &
math_deviatoric33, &
math_mul33xx33, &
math_transpose33
math_mul33xx33
use material, only: &
phasememberAt, &
material_phase, &
@ -374,7 +288,7 @@ subroutine plastic_isotropic_LpAndItsTangent(Lp,dLp_dTstar99,Tstar_v,ipc,ip,el)
ip, & !< integration point
el !< element
type(tParameters), pointer :: p
type(tParameters), pointer :: prm
real(pReal), dimension(3,3) :: &
Tstar_dev_33 !< deviatoric part of the 2nd Piola Kirchhoff stress tensor as 2nd order tensor
@ -390,7 +304,7 @@ subroutine plastic_isotropic_LpAndItsTangent(Lp,dLp_dTstar99,Tstar_v,ipc,ip,el)
of = phasememberAt(ipc,ip,el) ! phasememberAt should be tackled by material and be renamed to material_phasemember
instance = phase_plasticityInstance(material_phase(ipc,ip,el))
p => param(instance)
prm => param(instance)
Tstar_dev_33 = math_deviatoric33(math_Mandel6to33(Tstar_v)) ! deviatoric part of 2nd Piola-Kirchhoff stress
squarenorm_Tstar_dev = math_mul33xx33(Tstar_dev_33,Tstar_dev_33)
@ -400,31 +314,31 @@ subroutine plastic_isotropic_LpAndItsTangent(Lp,dLp_dTstar99,Tstar_v,ipc,ip,el)
Lp = 0.0_pReal
dLp_dTstar99 = 0.0_pReal
else
gamma_dot = p%gdot0 &
* ( sqrt(1.5_pReal) * norm_Tstar_dev / p%fTaylor / state(instance)%flowstress(of) ) &
**p%n
gamma_dot = prm%gdot0 &
* ( sqrt(1.5_pReal) * norm_Tstar_dev / prm%fTaylor / state(instance)%flowstress(of) ) &
**prm%n
Lp = Tstar_dev_33/norm_Tstar_dev * gamma_dot/p%fTaylor
Lp = Tstar_dev_33/norm_Tstar_dev * gamma_dot/prm%fTaylor
if (iand(debug_level(debug_constitutive), debug_levelExtensive) /= 0_pInt &
.and. ((el == debug_e .and. ip == debug_i .and. ipc == debug_g) &
.or. .not. iand(debug_level(debug_constitutive),debug_levelSelective) /= 0_pInt)) then
write(6,'(a,i8,1x,i2,1x,i3)') '<< CONST isotropic >> at el ip g ',el,ip,ipc
write(6,'(/,a,/,3(12x,3(f12.4,1x)/))') '<< CONST isotropic >> Tstar (dev) / MPa', &
math_transpose33(Tstar_dev_33(1:3,1:3))*1.0e-6_pReal
transpose(Tstar_dev_33(1:3,1:3))*1.0e-6_pReal
write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> norm Tstar / MPa', norm_Tstar_dev*1.0e-6_pReal
write(6,'(/,a,/,f12.5)') '<< CONST isotropic >> gdot', gamma_dot
end if
!--------------------------------------------------------------------------------------------------
! Calculation of the tangent of Lp
forall (k=1_pInt:3_pInt,l=1_pInt:3_pInt,m=1_pInt:3_pInt,n=1_pInt:3_pInt) &
dLp_dTstar_3333(k,l,m,n) = (p%n-1.0_pReal) * &
dLp_dTstar_3333(k,l,m,n) = (prm%n-1.0_pReal) * &
Tstar_dev_33(k,l)*Tstar_dev_33(m,n) / squarenorm_Tstar_dev
forall (k=1_pInt:3_pInt,l=1_pInt:3_pInt) &
dLp_dTstar_3333(k,l,k,l) = dLp_dTstar_3333(k,l,k,l) + 1.0_pReal
forall (k=1_pInt:3_pInt,m=1_pInt:3_pInt) &
dLp_dTstar_3333(k,k,m,m) = dLp_dTstar_3333(k,k,m,m) - 1.0_pReal/3.0_pReal
dLp_dTstar99 = math_Plain3333to99(gamma_dot / p%fTaylor * &
dLp_dTstar99 = math_Plain3333to99(gamma_dot / prm%fTaylor * &
dLp_dTstar_3333 / norm_Tstar_dev)
end if
end subroutine plastic_isotropic_LpAndItsTangent
@ -456,7 +370,7 @@ subroutine plastic_isotropic_LiAndItsTangent(Li,dLi_dTstar_3333,Tstar_v,ipc,ip,e
ip, & !< integration point
el !< element
type(tParameters), pointer :: p
type(tParameters), pointer :: prm
real(pReal), dimension(3,3) :: &
Tstar_sph_33 !< sphiatoric part of the 2nd Piola Kirchhoff stress tensor as 2nd order tensor
@ -470,28 +384,28 @@ subroutine plastic_isotropic_LiAndItsTangent(Li,dLi_dTstar_3333,Tstar_v,ipc,ip,e
of = phasememberAt(ipc,ip,el) ! phasememberAt should be tackled by material and be renamed to material_phasemember
instance = phase_plasticityInstance(material_phase(ipc,ip,el))
p => param(instance)
prm => param(instance)
Tstar_sph_33 = math_spherical33(math_Mandel6to33(Tstar_v)) ! spherical part of 2nd Piola-Kirchhoff stress
squarenorm_Tstar_sph = math_mul33xx33(Tstar_sph_33,Tstar_sph_33)
norm_Tstar_sph = sqrt(squarenorm_Tstar_sph)
if (p%dilatation .and. norm_Tstar_sph > 0.0_pReal) then ! Tstar == 0 or J2 plascitiy --> both Li and dLi_dTstar are zero
gamma_dot = p%gdot0 &
* (sqrt(1.5_pReal) * norm_Tstar_sph / p%fTaylor / state(instance)%flowstress(of) ) &
**p%n
if (prm%dilatation .and. norm_Tstar_sph > 0.0_pReal) then ! Tstar == 0 or J2 plascitiy --> both Li and dLi_dTstar are zero
gamma_dot = prm%gdot0 &
* (sqrt(1.5_pReal) * norm_Tstar_sph / prm%fTaylor / state(instance)%flowstress(of) ) &
**prm%n
Li = Tstar_sph_33/norm_Tstar_sph * gamma_dot/p%fTaylor
Li = Tstar_sph_33/norm_Tstar_sph * gamma_dot/prm%fTaylor
!--------------------------------------------------------------------------------------------------
! Calculation of the tangent of Li
forall (k=1_pInt:3_pInt,l=1_pInt:3_pInt,m=1_pInt:3_pInt,n=1_pInt:3_pInt) &
dLi_dTstar_3333(k,l,m,n) = (p%n-1.0_pReal) * &
dLi_dTstar_3333(k,l,m,n) = (prm%n-1.0_pReal) * &
Tstar_sph_33(k,l)*Tstar_sph_33(m,n) / squarenorm_Tstar_sph
forall (k=1_pInt:3_pInt,l=1_pInt:3_pInt) &
dLi_dTstar_3333(k,l,k,l) = dLi_dTstar_3333(k,l,k,l) + 1.0_pReal
dLi_dTstar_3333 = gamma_dot / p%fTaylor * &
dLi_dTstar_3333 = gamma_dot / prm%fTaylor * &
dLi_dTstar_3333 / norm_Tstar_sph
else
Li = 0.0_pReal
@ -520,7 +434,7 @@ subroutine plastic_isotropic_dotState(Tstar_v,ipc,ip,el)
ipc, & !< component-ID of integration point
ip, & !< integration point
el !< element
type(tParameters), pointer :: p
type(tParameters), pointer :: prm
real(pReal), dimension(6) :: &
Tstar_dev_v !< deviatoric 2nd Piola Kirchhoff stress tensor in Mandel notation
real(pReal) :: &
@ -534,11 +448,11 @@ subroutine plastic_isotropic_dotState(Tstar_v,ipc,ip,el)
of = phasememberAt(ipc,ip,el) ! phasememberAt should be tackled by material and be renamed to material_phasemember
instance = phase_plasticityInstance(material_phase(ipc,ip,el))
p => param(instance)
prm => param(instance)
!--------------------------------------------------------------------------------------------------
! norm of (deviatoric) 2nd Piola-Kirchhoff stress
if (p%dilatation) then
if (prm%dilatation) then
norm_Tstar_v = sqrt(math_mul6x6(Tstar_v,Tstar_v))
else
Tstar_dev_v(1:3) = Tstar_v(1:3) - sum(Tstar_v(1:3))/3.0_pReal
@ -547,26 +461,26 @@ subroutine plastic_isotropic_dotState(Tstar_v,ipc,ip,el)
end if
!--------------------------------------------------------------------------------------------------
! strain rate
gamma_dot = p%gdot0 * ( sqrt(1.5_pReal) * norm_Tstar_v &
gamma_dot = prm%gdot0 * ( sqrt(1.5_pReal) * norm_Tstar_v &
/ &!-----------------------------------------------------------------------------------
(p%fTaylor*state(instance)%flowstress(of) ))**p%n
(prm%fTaylor*state(instance)%flowstress(of) ))**prm%n
!--------------------------------------------------------------------------------------------------
! hardening coefficient
if (abs(gamma_dot) > 1e-12_pReal) then
if (dEq0(p%tausat_SinhFitA)) then
saturation = p%tausat
if (dEq0(prm%tausat_SinhFitA)) then
saturation = prm%tausat
else
saturation = p%tausat &
+ asinh( (gamma_dot / p%tausat_SinhFitA&
)**(1.0_pReal / p%tausat_SinhFitD)&
)**(1.0_pReal / p%tausat_SinhFitC) &
/ ( p%tausat_SinhFitB &
* (gamma_dot / p%gdot0)**(1.0_pReal / p%n) &
saturation = prm%tausat &
+ asinh( (gamma_dot / prm%tausat_SinhFitA&
)**(1.0_pReal / prm%tausat_SinhFitD)&
)**(1.0_pReal / prm%tausat_SinhFitC) &
/ ( prm%tausat_SinhFitB &
* (gamma_dot / prm%gdot0)**(1.0_pReal / prm%n) &
)
endif
hardening = ( p%h0 + p%h0_slopeLnRate * log(gamma_dot) ) &
* abs( 1.0_pReal - state(instance)%flowstress(of)/saturation )**p%a &
hardening = ( prm%h0 + prm%h0_slopeLnRate * log(gamma_dot) ) &
* abs( 1.0_pReal - state(instance)%flowstress(of)/saturation )**prm%a &
* sign(1.0_pReal, 1.0_pReal - state(instance)%flowstress(of)/saturation)
else
hardening = 0.0_pReal
@ -584,6 +498,7 @@ function plastic_isotropic_postResults(Tstar_v,ipc,ip,el)
use math, only: &
math_mul6x6
use material, only: &
plasticState, &
material_phase, &
phasememberAt, &
phase_plasticityInstance
@ -596,9 +511,9 @@ function plastic_isotropic_postResults(Tstar_v,ipc,ip,el)
ip, & !< integration point
el !< element
type(tParameters), pointer :: p
type(tParameters), pointer :: prm
real(pReal), dimension(plastic_isotropic_sizePostResults(phase_plasticityInstance(material_phase(ipc,ip,el)))) :: &
real(pReal), dimension(plasticState(material_phase(ipc,ip,el))%sizePostResults) :: &
plastic_isotropic_postResults
real(pReal), dimension(6) :: &
@ -613,11 +528,11 @@ function plastic_isotropic_postResults(Tstar_v,ipc,ip,el)
of = phasememberAt(ipc,ip,el) ! phasememberAt should be tackled by material and be renamed to material_phasemember
instance = phase_plasticityInstance(material_phase(ipc,ip,el))
p => param(instance)
prm => param(instance)
!--------------------------------------------------------------------------------------------------
! norm of (deviatoric) 2nd Piola-Kirchhoff stress
if (p%dilatation) then
if (prm%dilatation) then
norm_Tstar_v = sqrt(math_mul6x6(Tstar_v,Tstar_v))
else
Tstar_dev_v(1:3) = Tstar_v(1:3) - sum(Tstar_v(1:3))/3.0_pReal
@ -629,15 +544,15 @@ function plastic_isotropic_postResults(Tstar_v,ipc,ip,el)
plastic_isotropic_postResults = 0.0_pReal
outputsLoop: do o = 1_pInt,plastic_isotropic_Noutput(instance)
select case(p%outputID(o))
select case(prm%outputID(o))
case (flowstress_ID)
plastic_isotropic_postResults(c+1_pInt) = state(instance)%flowstress(of)
c = c + 1_pInt
case (strainrate_ID)
plastic_isotropic_postResults(c+1_pInt) = &
p%gdot0 * ( sqrt(1.5_pReal) * norm_Tstar_v &
prm%gdot0 * ( sqrt(1.5_pReal) * norm_Tstar_v &
/ &!----------------------------------------------------------------------------------
(p%fTaylor * state(instance)%flowstress(of)) ) ** p%n
(prm%fTaylor * state(instance)%flowstress(of)) ) ** prm%n
c = c + 1_pInt
end select
enddo outputsLoop

5
src/plastic_kinematichardening.f90
View File

@ -1,6 +1,7 @@
!--------------------------------------------------------------------------------------------------
!> @author Philip Eisenlohr, Michigan State University
!> @author Zhuowen Zhao, Michigan State University
!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
!> @brief Introducing Voce-type kinematic hardening rule into crystal plasticity
!! formulation using a power law fitting
!--------------------------------------------------------------------------------------------------
@ -145,7 +146,8 @@ subroutine plastic_kinehardening_init(fileUnit)
phase_plasticityInstance, &
phase_Noutput, &
material_phase, &
plasticState, &
plasticState
use config, only: &
MATERIAL_partPhase
use lattice
use numerics,only: &
@ -230,6 +232,7 @@ subroutine plastic_kinehardening_init(fileUnit)
allocate(param(instance)%nonSchmidCoeff(Nchunks_nonSchmid), source=0.0_pReal)
if(allocated(tempPerSlip)) deallocate(tempPerSlip)
allocate(tempPerSlip(Nchunks_SlipFamilies))
allocate(param(instance)%outputID(0))
endif
cycle ! skip to next line
endif

2
src/plastic_nonlocal.f90
View File

@ -291,8 +291,8 @@ use material, only: phase_plasticity, &
PLASTICITY_NONLOCAL_label, &
PLASTICITY_NONLOCAL_ID, &
plasticState, &
MATERIAL_partPhase ,&
material_phase
use config, only: MATERIAL_partPhase
use lattice
use numerics,only: &
numerics_integrator

3
src/plastic_phenopowerlaw.f90
View File

@ -157,7 +157,8 @@ subroutine plastic_phenopowerlaw_init(fileUnit)
PLASTICITY_PHENOPOWERLAW_label, &
PLASTICITY_PHENOPOWERLAW_ID, &
material_phase, &
plasticState, &
plasticState
use config, only: &
MATERIAL_partPhase
use lattice
use numerics,only: &

1
src/porosity_none.f90
View File

@ -27,6 +27,7 @@ subroutine porosity_none_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &

11
src/porosity_phasefield.f90
View File

@ -77,11 +77,10 @@ subroutine porosity_phasefield_init(fileUnit)
porosityState, &
porosityMapping, &
porosity, &
porosity_initialPhi, &
porosity_initialPhi
use config, only: &
material_partHomogenization, &
material_partPhase
use numerics,only: &
worldrank
implicit none
integer(pInt), intent(in) :: fileUnit
@ -94,11 +93,9 @@ subroutine porosity_phasefield_init(fileUnit)
tag = '', &
line = ''
mainProcess: if (worldrank == 0) then
write(6,'(/,a)') ' <<<+- porosity_'//POROSITY_phasefield_label//' init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
write(6,'(/,a)') ' <<<+- porosity_'//POROSITY_phasefield_label//' init -+>>>'
write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
#include "compilation_info.f90"
endif mainProcess
maxNinstance = int(count(porosity_type == POROSITY_phasefield_ID),pInt)
if (maxNinstance == 0_pInt) return

5
src/source_damage_anisoBrittle.f90
View File

@ -91,9 +91,10 @@ subroutine source_damage_anisoBrittle_init(fileUnit)
phase_Noutput, &
SOURCE_damage_anisoBrittle_label, &
SOURCE_damage_anisoBrittle_ID, &
material_phase, &
sourceState
use config, only: &
material_Nphase, &
material_phase, &
sourceState, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_damage_anisoDuctile.f90
View File

@ -95,9 +95,10 @@ subroutine source_damage_anisoDuctile_init(fileUnit)
phase_Noutput, &
SOURCE_damage_anisoDuctile_label, &
SOURCE_damage_anisoDuctile_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_damage_isoBrittle.f90
View File

@ -81,9 +81,10 @@ subroutine source_damage_isoBrittle_init(fileUnit)
phase_Noutput, &
SOURCE_damage_isoBrittle_label, &
SOURCE_damage_isoBrittle_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

6
src/source_damage_isoDuctile.f90
View File

@ -81,10 +81,12 @@ subroutine source_damage_isoDuctile_init(fileUnit)
phase_Noutput, &
SOURCE_damage_isoDuctile_label, &
SOURCE_damage_isoDuctile_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_thermal_dissipation.f90
View File

@ -67,9 +67,10 @@ subroutine source_thermal_dissipation_init(fileUnit)
phase_Noutput, &
SOURCE_thermal_dissipation_label, &
SOURCE_thermal_dissipation_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_thermal_externalheat.f90
View File

@ -73,9 +73,10 @@ subroutine source_thermal_externalheat_init(fileUnit)
phase_Noutput, &
SOURCE_thermal_externalheat_label, &
SOURCE_thermal_externalheat_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_vacancy_irradiation.f90
View File

@ -69,9 +69,10 @@ subroutine source_vacancy_irradiation_init(fileUnit)
phase_Noutput, &
SOURCE_vacancy_irradiation_label, &
SOURCE_vacancy_irradiation_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_vacancy_phenoplasticity.f90
View File

@ -67,9 +67,10 @@ subroutine source_vacancy_phenoplasticity_init(fileUnit)
phase_Noutput, &
SOURCE_vacancy_phenoplasticity_label, &
SOURCE_vacancy_phenoplasticity_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/source_vacancy_thermalfluc.f90
View File

@ -71,9 +71,10 @@ subroutine source_vacancy_thermalfluc_init(fileUnit)
phase_Noutput, &
SOURCE_vacancy_thermalfluc_label, &
SOURCE_vacancy_thermalfluc_ID, &
material_Nphase, &
material_phase, &
sourceState, &
sourceState
use config, only: &
material_Nphase, &
MATERIAL_partPhase
use numerics,only: &
numerics_integrator

5
src/thermal_adiabatic.f90
View File

@ -64,6 +64,8 @@ subroutine thermal_adiabatic_init(fileUnit)
IO_error, &
IO_timeStamp, &
IO_EOF
use config, only: &
material_partHomogenization
use material, only: &
thermal_type, &
thermal_typeInstance, &
@ -76,8 +78,7 @@ subroutine thermal_adiabatic_init(fileUnit)
thermalMapping, &
thermal_initialT, &
temperature, &
temperatureRate, &
material_partHomogenization
temperatureRate
implicit none
integer(pInt), intent(in) :: fileUnit

3
src/thermal_conduction.f90
View File

@ -77,7 +77,8 @@ subroutine thermal_conduction_init(fileUnit)
thermalMapping, &
thermal_initialT, &
temperature, &
temperatureRate, &
temperatureRate
use config, only: &
material_partHomogenization
implicit none

1
src/thermal_isothermal.f90
View File

@ -27,6 +27,7 @@ subroutine thermal_isothermal_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &

7
src/vacancyflux_cahnhilliard.f90
View File

@ -91,9 +91,10 @@ subroutine vacancyflux_cahnhilliard_init(fileUnit)
vacancyfluxMapping, &
vacancyConc, &
vacancyConcRate, &
vacancyflux_initialCv, &
material_partHomogenization, &
material_partPhase
vacancyflux_initialCv
use config, only: &
material_partPhase, &
material_partHomogenization
implicit none
integer(pInt), intent(in) :: fileUnit

3
src/vacancyflux_isochempot.f90
View File

@ -74,7 +74,8 @@ subroutine vacancyflux_isochempot_init(fileUnit)
vacancyfluxMapping, &
vacancyConc, &
vacancyConcRate, &
vacancyflux_initialCv, &
vacancyflux_initialCv
use config, only: &
material_partHomogenization
implicit none

1
src/vacancyflux_isoconc.f90
View File

@ -27,6 +27,7 @@ subroutine vacancyflux_isoconc_init()
use IO, only: &
IO_timeStamp
use material
use config
implicit none
integer(pInt) :: &