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added enum for dislotwin output, fixed bug when using recursive file input function

This commit is contained in:
Martin Diehl 2013-12-11 23:42:33 +00:00
parent 95d6430b09
commit 102712d91f
3 changed files with 312 additions and 300 deletions
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426
code/constitutive_dislotwin.f90
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@ -29,7 +29,7 @@ module constitutive_dislotwin
pReal, &
pInt
use lattice, only: &
LATTICE_iso_ID
LATTICE_undefined_ID
implicit none
private
@ -38,7 +38,7 @@ module constitutive_dislotwin
constitutive_dislotwin_sizeState, & !< total number of microstructural state variables
constitutive_dislotwin_sizePostResults !< cumulative size of post results
integer(kind(LATTICE_iso_ID)), dimension(:), allocatable, public :: &
integer(kind(LATTICE_undefined_ID)), dimension(:), allocatable, public :: &
constitutive_dislotwin_structureID !< ID of the lattice structure !< name of the lattice structure
integer(pInt), dimension(:,:), allocatable, target, public :: &
@ -148,6 +148,31 @@ module constitutive_dislotwin
real(pReal), dimension(:,:,:,:,:), allocatable, private :: &
constitutive_dislotwin_sbSv
enum, bind(c)
enumerator :: undefined_ID, &
edge_density_ID, &
dipole_density_ID, &
shear_rate_slip_ID, &
accumulated_shear_slip_ID, &
mfp_slip_ID, &
resolved_stress_slip_ID, &
threshold_stress_slip_ID, &
edge_dipole_distance_ID, &
stress_exponent_ID, &
twin_fraction_ID, &
shear_rate_twin_ID, &
accumulated_shear_twin_ID, &
mfp_twin_ID, &
resolved_stress_twin_ID, &
threshold_stress_twin_ID, &
resolved_stress_shearband_ID, &
shear_rate_shearband_ID, &
sb_eigenvalues_ID, &
sb_eigenvectors_ID
end enum
integer(kind(undefined_ID)), dimension(:,:), allocatable, private :: &
constitutive_dislotwin_outputID !< ID of each post result output
public :: &
constitutive_dislotwin_init, &
@ -166,7 +191,7 @@ contains
!> @brief module initialization
!> @details reads in material parameters, allocates arrays, and does sanity checks
!--------------------------------------------------------------------------------------------------
subroutine constitutive_dislotwin_init(file)
subroutine constitutive_dislotwin_init(fileUnit)
use, intrinsic :: iso_fortran_env ! to get compiler_version and compiler_options (at least for gfortran 4.6 at the moment)
use debug, only: &
debug_level,&
@ -184,7 +209,7 @@ subroutine constitutive_dislotwin_init(file)
use lattice
implicit none
integer(pInt), intent(in) :: file
integer(pInt), intent(in) :: fileUnit
integer(pInt), parameter :: MAXNCHUNKS = LATTICE_maxNinteraction + 1_pInt
integer(pInt), dimension(1+2*MAXNCHUNKS) :: positions
@ -219,124 +244,87 @@ subroutine constitutive_dislotwin_init(file)
Nchunks_TwinTwin = lattice_maxNinteraction
!* Space allocation for global variables
allocate(constitutive_dislotwin_sizeDotState(maxNinstance))
constitutive_dislotwin_sizeDotState = 0_pInt
allocate(constitutive_dislotwin_sizeState(maxNinstance))
constitutive_dislotwin_sizeState = 0_pInt
allocate(constitutive_dislotwin_sizePostResults(maxNinstance))
constitutive_dislotwin_sizePostResults = 0_pInt
allocate(constitutive_dislotwin_sizePostResult(maxval(phase_Noutput),maxNinstance))
constitutive_dislotwin_sizePostResult = 0_pInt
allocate(constitutive_dislotwin_sizeDotState(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_sizeState(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_sizePostResults(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_sizePostResult(maxval(phase_Noutput),maxNinstance),source=0_pInt)
allocate(constitutive_dislotwin_output(maxval(phase_Noutput),maxNinstance))
constitutive_dislotwin_output = ''
allocate(constitutive_dislotwin_Noutput(maxNinstance))
constitutive_dislotwin_Noutput = 0_pInt
allocate(constitutive_dislotwin_structureID(maxNinstance))
constitutive_dislotwin_structureID = -1
allocate(constitutive_dislotwin_structure(maxNinstance))
constitutive_dislotwin_structure = 0_pInt
allocate(constitutive_dislotwin_Nslip(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_Nslip = 0_pInt
allocate(constitutive_dislotwin_Ntwin(lattice_maxNtwinFamily,maxNinstance))
constitutive_dislotwin_Ntwin = 0_pInt
allocate(constitutive_dislotwin_totalNslip(maxNinstance))
constitutive_dislotwin_totalNslip = 0_pInt
allocate(constitutive_dislotwin_totalNtwin(maxNinstance))
constitutive_dislotwin_totalNtwin = 0_pInt
allocate(constitutive_dislotwin_CoverA(maxNinstance))
constitutive_dislotwin_CoverA = 0.0_pReal
allocate(constitutive_dislotwin_Gmod(maxNinstance))
constitutive_dislotwin_Gmod = 0.0_pReal
allocate(constitutive_dislotwin_nu(maxNinstance))
constitutive_dislotwin_nu = 0.0_pReal
allocate(constitutive_dislotwin_CAtomicVolume(maxNinstance))
constitutive_dislotwin_CAtomicVolume = 0.0_pReal
allocate(constitutive_dislotwin_D0(maxNinstance))
constitutive_dislotwin_D0 = 0.0_pReal
allocate(constitutive_dislotwin_Qsd(maxNinstance))
constitutive_dislotwin_Qsd = 0.0_pReal
allocate(constitutive_dislotwin_GrainSize(maxNinstance))
constitutive_dislotwin_GrainSize = 0.0_pReal
allocate(constitutive_dislotwin_p(maxNinstance))
constitutive_dislotwin_p = 0.0_pReal
allocate(constitutive_dislotwin_q(maxNinstance))
constitutive_dislotwin_q = 0.0_pReal
allocate(constitutive_dislotwin_MaxTwinFraction(maxNinstance))
constitutive_dislotwin_MaxTwinFraction = 0.0_pReal
allocate(constitutive_dislotwin_r(maxNinstance))
constitutive_dislotwin_r = 0.0_pReal
allocate(constitutive_dislotwin_CEdgeDipMinDistance(maxNinstance))
constitutive_dislotwin_CEdgeDipMinDistance = 0.0_pReal
allocate(constitutive_dislotwin_Cmfptwin(maxNinstance))
constitutive_dislotwin_Cmfptwin = 0.0_pReal
allocate(constitutive_dislotwin_Cthresholdtwin(maxNinstance))
constitutive_dislotwin_Cthresholdtwin = 0.0_pReal
allocate(constitutive_dislotwin_SolidSolutionStrength(maxNinstance))
constitutive_dislotwin_SolidSolutionStrength = 0.0_pReal
allocate(constitutive_dislotwin_L0(maxNinstance))
constitutive_dislotwin_L0 = 0.0_pReal
allocate(constitutive_dislotwin_xc(maxNinstance))
constitutive_dislotwin_xc = 0.0_pReal
allocate(constitutive_dislotwin_VcrossSlip(maxNinstance))
constitutive_dislotwin_VcrossSlip = 0.0_pReal
allocate(constitutive_dislotwin_aTolRho(maxNinstance))
constitutive_dislotwin_aTolRho = 0.0_pReal
allocate(constitutive_dislotwin_aTolTwinFrac(maxNinstance))
constitutive_dislotwin_aTolTwinFrac = 0.0_pReal
allocate(constitutive_dislotwin_Cslip_66(6,6,maxNinstance))
constitutive_dislotwin_Cslip_66 = 0.0_pReal
allocate(constitutive_dislotwin_Cslip_3333(3,3,3,3,maxNinstance))
constitutive_dislotwin_Cslip_3333 = 0.0_pReal
allocate(constitutive_dislotwin_sbResistance(maxNinstance))
constitutive_dislotwin_sbResistance = 0.0_pReal
allocate(constitutive_dislotwin_sbVelocity(maxNinstance))
constitutive_dislotwin_sbVelocity = 0.0_pReal
allocate(constitutive_dislotwin_sbQedge(maxNinstance))
constitutive_dislotwin_sbQedge = 0.0_pReal
allocate(constitutive_dislotwin_SFE_0K(maxNinstance))
constitutive_dislotwin_SFE_0K = 0.0_pReal
allocate(constitutive_dislotwin_dSFE_dT(maxNinstance))
constitutive_dislotwin_dSFE_dT = 0.0_pReal
allocate(constitutive_dislotwin_rhoEdge0(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_rhoEdge0 = 0.0_pReal
allocate(constitutive_dislotwin_rhoEdgeDip0(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_rhoEdgeDip0 = 0.0_pReal
allocate(constitutive_dislotwin_burgersPerSlipFamily(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_burgersPerSlipFamily = 0.0_pReal
allocate(constitutive_dislotwin_burgersPerTwinFamily(lattice_maxNtwinFamily,maxNinstance))
constitutive_dislotwin_burgersPerTwinFamily = 0.0_pReal
allocate(constitutive_dislotwin_QedgePerSlipFamily(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_QedgePerSlipFamily = 0.0_pReal
allocate(constitutive_dislotwin_v0PerSlipFamily(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_v0PerSlipFamily = 0.0_pReal
allocate(constitutive_dislotwin_Ndot0PerTwinFamily(lattice_maxNtwinFamily,maxNinstance))
constitutive_dislotwin_Ndot0PerTwinFamily = 0.0_pReal
allocate(constitutive_dislotwin_twinsizePerTwinFamily(lattice_maxNtwinFamily,maxNinstance))
constitutive_dislotwin_twinsizePerTwinFamily = 0.0_pReal
allocate(constitutive_dislotwin_CLambdaSlipPerSlipFamily(lattice_maxNslipFamily,maxNinstance))
constitutive_dislotwin_CLambdaSlipPerSlipFamily = 0.0_pReal
allocate(constitutive_dislotwin_interaction_SlipSlip(lattice_maxNinteraction,maxNinstance))
constitutive_dislotwin_interaction_SlipSlip = 0.0_pReal
allocate(constitutive_dislotwin_interaction_SlipTwin(lattice_maxNinteraction,maxNinstance))
constitutive_dislotwin_interaction_SlipTwin = 0.0_pReal
allocate(constitutive_dislotwin_interaction_TwinSlip(lattice_maxNinteraction,maxNinstance))
constitutive_dislotwin_interaction_TwinSlip = 0.0_pReal
allocate(constitutive_dislotwin_interaction_TwinTwin(lattice_maxNinteraction,maxNinstance))
constitutive_dislotwin_interaction_TwinTwin = 0.0_pReal
allocate(constitutive_dislotwin_sbSv(6,6,homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems))
constitutive_dislotwin_sbSv = 0.0_pReal
allocate(constitutive_dislotwin_outputID(maxval(phase_Noutput),maxNinstance), source=undefined_ID)
allocate(constitutive_dislotwin_Noutput(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_structureID(maxNinstance), source=LATTICE_undefined_ID)
allocate(constitutive_dislotwin_structure(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_Nslip(lattice_maxNslipFamily,maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_Ntwin(lattice_maxNtwinFamily,maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_totalNslip(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_totalNtwin(maxNinstance), source=0_pInt)
allocate(constitutive_dislotwin_CoverA(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Gmod(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_nu(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_CAtomicVolume(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_D0(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Qsd(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_GrainSize(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_p(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_q(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_MaxTwinFraction(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_r(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_CEdgeDipMinDistance(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Cmfptwin(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Cthresholdtwin(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_SolidSolutionStrength(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_L0(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_xc(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_VcrossSlip(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_aTolRho(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_aTolTwinFrac(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Cslip_66(6,6,maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Cslip_3333(3,3,3,3,maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_sbResistance(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_sbVelocity(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_sbQedge(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_SFE_0K(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_dSFE_dT(maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_rhoEdge0(lattice_maxNslipFamily,maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_rhoEdgeDip0(lattice_maxNslipFamily,maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_burgersPerSlipFamily(lattice_maxNslipFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_burgersPerTwinFamily(lattice_maxNtwinFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_QedgePerSlipFamily(lattice_maxNslipFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_v0PerSlipFamily(lattice_maxNslipFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_Ndot0PerTwinFamily(lattice_maxNtwinFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_twinsizePerTwinFamily(lattice_maxNtwinFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_CLambdaSlipPerSlipFamily(lattice_maxNslipFamily,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interaction_SlipSlip(lattice_maxNinteraction,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interaction_SlipTwin(lattice_maxNinteraction,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interaction_TwinSlip(lattice_maxNinteraction,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interaction_TwinTwin(lattice_maxNinteraction,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_sbSv(6,6,homogenization_maxNgrains,mesh_maxNips,mesh_NcpElems), &
source=0.0_pReal)
rewind(file)
do while (trim(line) /= '#EOF#' .and. IO_lc(IO_getTag(line,'<','>')) /= 'phase') ! wind forward to <phase>
line = IO_read(file)
rewind(fileUnit)
do while (trim(line) /= IO_EOF .and. IO_lc(IO_getTag(line,'<','>')) /= 'phase') ! wind forward to <phase>
line = IO_read(fileUnit)
enddo
do while (trim(line) /= '#EOF#') ! read thru sections of phase part
line = IO_read(file)
do while (trim(line) /= IO_EOF) ! read thru sections of phase part
line = IO_read(fileUnit)
if (IO_isBlank(line)) cycle ! skip empty lines
if (IO_getTag(line,'<','>') /= '') exit ! stop at next part
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 ! advance section counter
cycle
@ -351,7 +339,46 @@ subroutine constitutive_dislotwin_init(file)
cycle
case ('(output)')
constitutive_dislotwin_Noutput(i) = constitutive_dislotwin_Noutput(i) + 1_pInt
constitutive_dislotwin_output(constitutive_dislotwin_Noutput(i),i) = IO_lc(IO_stringValue(line,positions,2_pInt))
constitutive_dislotwin_output(constitutive_dislotwin_Noutput(i),i) = &
IO_lc(IO_stringValue(line,positions,2_pInt))
select case(IO_lc(IO_stringValue(line,positions,2_pInt)))
case ('edge_density')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = edge_density_ID
case ('dipole_density')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = dipole_density_ID
case ('shear_rate_slip')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = shear_rate_slip_ID
case ('accumulated_shear_slip')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = accumulated_shear_slip_ID
case ('mfp_slip')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = mfp_slip_ID
case ('resolved_stress_slip')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = resolved_stress_slip_ID
case ('edge_dipole_distance')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = edge_dipole_distance_ID
case ('stress_exponent')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = stress_exponent_ID
case ('twin_fraction')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = twin_fraction_ID
case ('shear_rate_twin')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = shear_rate_twin_ID
case ('accumulated_shear_twin')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = accumulated_shear_twin_ID
case ('mfp_twin')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = mfp_twin_ID
case ('resolved_stress_twin')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = resolved_stress_twin_ID
case ('threshold_stress_twin')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = threshold_stress_twin_ID
case ('resolved_stress_shearband')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = resolved_stress_shearband_ID
case ('shear_rate_shearband')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = shear_rate_shearband_ID
case ('sb_eigenvalues')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = sb_eigenvalues_ID
case ('sb_eigenvectors')
constitutive_dislotwin_outputID(constitutive_dislotwin_Noutput(i),i) = sb_eigenvectors_ID
end select
case ('lattice_structure')
structure = IO_lc(IO_stringValue(line,positions,2_pInt))
select case(structure(1:3))
@ -578,41 +605,28 @@ subroutine constitutive_dislotwin_init(file)
maxTotalNslip = maxval(constitutive_dislotwin_totalNslip)
maxTotalNtwin = maxval(constitutive_dislotwin_totalNtwin)
!write(6,*) 'nslip',i,constitutive_dislotwin_totalNslip(i),maxTotalNslip
!write(6,*) 'ntwin',i,constitutive_dislotwin_totalNtwin(i),maxTotalNtwin
allocate(constitutive_dislotwin_burgersPerSlipSystem(maxTotalNslip, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_burgersPerTwinSystem(maxTotalNtwin, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_QedgePerSlipSystem(maxTotalNslip, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_v0PerSlipSystem(maxTotalNslip, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Ndot0PerTwinSystem(maxTotalNtwin, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_tau_r(maxTotalNtwin, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_twinsizePerTwinSystem(maxTotalNtwin, maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_CLambdaSlipPerSlipSystem(maxTotalNslip, maxNinstance),source=0.0_pReal)
allocate(constitutive_dislotwin_burgersPerSlipSystem(maxTotalNslip, maxNinstance))
constitutive_dislotwin_burgersPerSlipSystem = 0.0_pReal
allocate(constitutive_dislotwin_burgersPerTwinSystem(maxTotalNtwin, maxNinstance))
constitutive_dislotwin_burgersPerTwinSystem= 0.0_pReal
allocate(constitutive_dislotwin_QedgePerSlipSystem(maxTotalNslip, maxNinstance))
constitutive_dislotwin_QedgePerSlipSystem = 0.0_pReal
allocate(constitutive_dislotwin_v0PerSlipSystem(maxTotalNslip, maxNinstance))
constitutive_dislotwin_v0PerSlipSystem = 0.0_pReal
allocate(constitutive_dislotwin_Ndot0PerTwinSystem(maxTotalNtwin, maxNinstance))
constitutive_dislotwin_Ndot0PerTwinSystem = 0.0_pReal
allocate(constitutive_dislotwin_tau_r(maxTotalNtwin, maxNinstance))
constitutive_dislotwin_tau_r = 0.0_pReal
allocate(constitutive_dislotwin_twinsizePerTwinSystem(maxTotalNtwin, maxNinstance))
constitutive_dislotwin_twinsizePerTwinSystem = 0.0_pReal
allocate(constitutive_dislotwin_CLambdaSlipPerSlipSystem(maxTotalNslip, maxNinstance))
constitutive_dislotwin_CLambdaSlipPerSlipSystem = 0.0_pReal
allocate(constitutive_dislotwin_interactionMatrix_SlipSlip(maxTotalNslip,maxTotalNslip,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interactionMatrix_SlipTwin(maxTotalNslip,maxTotalNtwin,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interactionMatrix_TwinSlip(maxTotalNtwin,maxTotalNslip,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interactionMatrix_TwinTwin(maxTotalNtwin,maxTotalNtwin,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_forestProjectionEdge(maxTotalNslip,maxTotalNslip,maxNinstance), &
source=0.0_pReal)
allocate(constitutive_dislotwin_interactionMatrix_SlipSlip(maxTotalNslip,maxTotalNslip,maxNinstance))
constitutive_dislotwin_interactionMatrix_SlipSlip = 0.0_pReal
allocate(constitutive_dislotwin_interactionMatrix_SlipTwin(maxTotalNslip,maxTotalNtwin,maxNinstance))
constitutive_dislotwin_interactionMatrix_SlipTwin = 0.0_pReal
allocate(constitutive_dislotwin_interactionMatrix_TwinSlip(maxTotalNtwin,maxTotalNslip,maxNinstance))
constitutive_dislotwin_interactionMatrix_TwinSlip = 0.0_pReal
allocate(constitutive_dislotwin_interactionMatrix_TwinTwin(maxTotalNtwin,maxTotalNtwin,maxNinstance))
constitutive_dislotwin_interactionMatrix_TwinTwin = 0.0_pReal
allocate(constitutive_dislotwin_forestProjectionEdge(maxTotalNslip,maxTotalNslip,maxNinstance))
constitutive_dislotwin_forestProjectionEdge = 0.0_pReal
allocate(constitutive_dislotwin_Ctwin_66(6,6,maxTotalNtwin,maxNinstance))
constitutive_dislotwin_Ctwin_66 = 0.0_pReal
allocate(constitutive_dislotwin_Ctwin_3333(3,3,3,3,maxTotalNtwin,maxNinstance))
constitutive_dislotwin_Ctwin_3333 = 0.0_pReal
allocate(constitutive_dislotwin_Ctwin_66(6,6,maxTotalNtwin,maxNinstance), source=0.0_pReal)
allocate(constitutive_dislotwin_Ctwin_3333(3,3,3,3,maxTotalNtwin,maxNinstance), source=0.0_pReal)
instancesLoop: do i = 1_pInt,maxNinstance
structID = constitutive_dislotwin_structure(i)
@ -629,33 +643,33 @@ subroutine constitutive_dislotwin_init(file)
!* Determine size of postResults array
outputsLoop: do o = 1_pInt,constitutive_dislotwin_Noutput(i)
select case(constitutive_dislotwin_output(o,i))
case('edge_density', &
'dipole_density', &
'shear_rate_slip', &
'accumulated_shear_slip', &
'mfp_slip', &
'resolved_stress_slip', &
'threshold_stress_slip', &
'edge_dipole_distance', &
'stress_exponent' &
select case(constitutive_dislotwin_outputID(o,i))
case(edge_density_ID, &
dipole_density_ID, &
shear_rate_slip_ID, &
accumulated_shear_slip_ID, &
mfp_slip_ID, &
resolved_stress_slip_ID, &
threshold_stress_slip_ID, &
edge_dipole_distance_ID, &
stress_exponent_ID &
)
mySize = ns
case('twin_fraction', &
'shear_rate_twin', &
'accumulated_shear_twin', &
'mfp_twin', &
'resolved_stress_twin', &
'threshold_stress_twin' &
case(twin_fraction_ID, &
shear_rate_twin_ID, &
accumulated_shear_twin_ID, &
mfp_twin_ID, &
resolved_stress_twin_ID, &
threshold_stress_twin_ID &
)
mySize = nt
case('resolved_stress_shearband', &
'shear_rate_shearband' &
case(resolved_stress_shearband_ID, &
shear_rate_shearband_ID &
)
mySize = 6_pInt
case('sb_eigenvalues')
case(sb_eigenvalues_ID)
mySize = 3_pInt
case('sb_eigenvectors')
case(sb_eigenvectors_ID)
mySize = 9_pInt
case default
call IO_error(212_pInt,ext_msg=constitutive_dislotwin_output(o,i)//' ('//PLASTICITY_DISLOTWIN_label//')')
@ -686,10 +700,9 @@ subroutine constitutive_dislotwin_init(file)
!* Process slip related parameters ------------------------------------------------
do f = 1_pInt,lattice_maxNslipFamily
slipFamiliesLoop: do f = 1_pInt,lattice_maxNslipFamily
index_myFamily = sum(constitutive_dislotwin_Nslip(1:f-1_pInt,i)) ! index in truncated slip system list
do j = 1_pInt,constitutive_dislotwin_Nslip(f,i) ! system in family
slipSystemsLoop: do j = 1_pInt,constitutive_dislotwin_Nslip(f,i)
!* Burgers vector,
! dislocation velocity prefactor,
@ -727,15 +740,14 @@ subroutine constitutive_dislotwin_init(file)
structID), i )
enddo; enddo
enddo ! slip system in family
enddo ! slip families
enddo slipSystemsLoop
enddo slipFamiliesLoop
!* Process twin related parameters ------------------------------------------------
do f = 1_pInt,lattice_maxNtwinFamily
twinFamiliesLoop: do f = 1_pInt,lattice_maxNtwinFamily
index_myFamily = sum(constitutive_dislotwin_Ntwin(1:f-1_pInt,i)) ! index in truncated twin system list
do j = 1_pInt,constitutive_dislotwin_Ntwin(f,i) ! system in family
twinSystemsLoop: do j = 1_pInt,constitutive_dislotwin_Ntwin(f,i)
!* Burgers vector,
! nucleation rate prefactor,
@ -784,8 +796,8 @@ subroutine constitutive_dislotwin_init(file)
structID), i )
enddo; enddo
enddo ! twin system in family
enddo ! twin families
enddo twinSystemsLoop
enddo twinFamiliesLoop
enddo instancesLoop
@ -1173,9 +1185,9 @@ subroutine constitutive_dislotwin_LpAndItsTangent(Lp,dLp_dTstar,Tstar_v,Temperat
gdot_slip = 0.0_pReal
dgdot_dtauslip = 0.0_pReal
j = 0_pInt
do f = 1_pInt,lattice_maxNslipFamily ! loop over all slip families
slipFamiliesLoop: do f = 1_pInt,lattice_maxNslipFamily
index_myFamily = sum(lattice_NslipSystem(1:f-1_pInt,structID)) ! at which index starts my family
do i = 1_pInt,constitutive_dislotwin_Nslip(f,matID) ! process each (active) slip system in family
slipSystemsLoop: do i = 1_pInt,constitutive_dislotwin_Nslip(f,matID)
j = j+1_pInt
!* Calculation of Lp
@ -1211,8 +1223,8 @@ subroutine constitutive_dislotwin_LpAndItsTangent(Lp,dLp_dTstar,Tstar_v,Temperat
dLp_dTstar3333(k,l,m,n) + dgdot_dtauslip(j)*&
lattice_Sslip(k,l,1,index_myFamily+i,structID)*&
lattice_Sslip(m,n,1,index_myFamily+i,structID)
enddo
enddo
enddo slipSystemsLoop
enddo slipFamiliesLoop
!* Shear banding (shearband) part
if(constitutive_dislotwin_sbVelocity(matID) /= 0.0_pReal .and. &
@ -1265,9 +1277,9 @@ subroutine constitutive_dislotwin_LpAndItsTangent(Lp,dLp_dTstar,Tstar_v,Temperat
gdot_twin = 0.0_pReal
dgdot_dtautwin = 0.0_pReal
j = 0_pInt
do f = 1_pInt,lattice_maxNtwinFamily ! loop over all slip families
twinFamiliesLoop: do f = 1_pInt,lattice_maxNtwinFamily
index_myFamily = sum(lattice_NtwinSystem(1:f-1_pInt,structID)) ! at which index starts my family
do i = 1_pInt,constitutive_dislotwin_Ntwin(f,matID) ! process each (active) slip system in family
twinSystemsLoop: do i = 1_pInt,constitutive_dislotwin_Ntwin(f,matID)
j = j+1_pInt
!* Calculation of Lp
@ -1310,8 +1322,8 @@ subroutine constitutive_dislotwin_LpAndItsTangent(Lp,dLp_dTstar,Tstar_v,Temperat
dLp_dTstar3333(k,l,m,n) + dgdot_dtautwin(j)*&
lattice_Stwin(k,l,index_myFamily+i,structID)*&
lattice_Stwin(m,n,index_myFamily+i,structID)
enddo
enddo
enddo twinSystemsLoop
enddo twinFamiliesLoop
dLp_dTstar = math_Plain3333to99(dLp_dTstar3333)
@ -1583,15 +1595,15 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
call math_spectralDecompositionSym33(math_Mandel6to33(Tstar_v),eigValues,eigVectors, error)
do o = 1_pInt,phase_Noutput(material_phase(ipc,ip,el))
select case(constitutive_dislotwin_output(o,matID))
select case(constitutive_dislotwin_outputID(o,matID))
case ('edge_density')
case (edge_density_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+ns) = state(ipc,ip,el)%p(1_pInt:ns)
c = c + ns
case ('dipole_density')
case (dipole_density_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+ns) = state(ipc,ip,el)%p(ns+1_pInt:2_pInt*ns)
c = c + ns
case ('shear_rate_slip')
case (shear_rate_slip_ID)
j = 0_pInt
do f = 1_pInt,lattice_maxNslipFamily ! loop over all slip families
index_myFamily = sum(lattice_NslipSystem(1:f-1_pInt,structID)) ! at which index starts my family
@ -1618,15 +1630,15 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
constitutive_dislotwin_q(matID))*sign(1.0_pReal,tau)
enddo ; enddo
c = c + ns
case ('accumulated_shear_slip')
case (accumulated_shear_slip_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+ns) = &
state(ipc,ip,el)%p((2_pInt*ns+1_pInt):(3_pInt*ns))
c = c + ns
case ('mfp_slip')
case (mfp_slip_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+ns) =&
state(ipc,ip,el)%p((5_pInt*ns+3_pInt*nt+1_pInt):(6_pInt*ns+3_pInt*nt))
c = c + ns
case ('resolved_stress_slip')
case (resolved_stress_slip_ID)
j = 0_pInt
do f = 1_pInt,lattice_maxNslipFamily ! loop over all slip families
index_myFamily = sum(lattice_NslipSystem(1:f-1_pInt,structID)) ! at which index starts my family
@ -1636,11 +1648,11 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
dot_product(Tstar_v,lattice_Sslip_v(:,1,index_myFamily+i,structID))
enddo; enddo
c = c + ns
case ('threshold_stress_slip')
case (threshold_stress_slip_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+ns) = &
state(ipc,ip,el)%p((6_pInt*ns+4_pInt*nt+1_pInt):(7_pInt*ns+4_pInt*nt))
c = c + ns
case ('edge_dipole_distance')
case (edge_dipole_distance_ID)
j = 0_pInt
do f = 1_pInt,lattice_maxNslipFamily ! loop over all slip families
index_myFamily = sum(lattice_NslipSystem(1:f-1_pInt,structID)) ! at which index starts my family
@ -1653,12 +1665,12 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
! constitutive_dislotwin_postResults(c+j) = max(constitutive_dislotwin_postResults(c+j),state(ipc,ip,el)%p(4*ns+2*nt+j))
enddo; enddo
c = c + ns
case ('resolved_stress_shearband')
case (resolved_stress_shearband_ID)
do j = 1_pInt,6_pInt ! loop over all shearband families
constitutive_dislotwin_postResults(c+j) = dot_product(Tstar_v, constitutive_dislotwin_sbSv(1:6,j,ipc,ip,el))
enddo
c = c + 6_pInt
case ('shear_rate_shearband')
case (shear_rate_shearband_ID)
do j = 1_pInt,6_pInt ! loop over all shearbands
!* Resolved shear stress on shearband system
tau = dot_product(Tstar_v,constitutive_dislotwin_sbSv(1:6,j,ipc,ip,el))
@ -1676,10 +1688,10 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
DotGamma0*exp(-BoltzmannRatio*(1_pInt-StressRatio_p)**constitutive_dislotwin_q(matID))*sign(1.0_pReal,tau)
enddo
c = c + 6_pInt
case ('twin_fraction')
case (twin_fraction_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+nt) = state(ipc,ip,el)%p((3_pInt*ns+1_pInt):(3_pInt*ns+nt))
c = c + nt
case ('shear_rate_twin')
case (shear_rate_twin_ID)
if (nt > 0_pInt) then
j = 0_pInt
@ -1745,13 +1757,13 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
enddo ; enddo
endif
c = c + nt
case ('accumulated_shear_twin')
case (accumulated_shear_twin_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+nt) = state(ipc,ip,el)%p((3_pInt*ns+nt+1_pInt):(3_pInt*ns+2_pInt*nt))
c = c + nt
case ('mfp_twin')
case (mfp_twin_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+nt) = state(ipc,ip,el)%p((6_pInt*ns+3_pInt*nt+1_pInt):(6_pInt*ns+4_pInt*nt))
c = c + nt
case ('resolved_stress_twin')
case (resolved_stress_twin_ID)
if (nt > 0_pInt) then
j = 0_pInt
do f = 1_pInt,lattice_maxNtwinFamily ! loop over all slip families
@ -1762,10 +1774,10 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
enddo; enddo
endif
c = c + nt
case ('threshold_stress_twin')
case (threshold_stress_twin_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+nt) = state(ipc,ip,el)%p((7_pInt*ns+4_pInt*nt+1_pInt):(7_pInt*ns+5_pInt*nt))
c = c + nt
case ('stress_exponent')
case (stress_exponent_ID)
j = 0_pInt
do f = 1_pInt,lattice_maxNslipFamily ! loop over all slip families
index_myFamily = sum(lattice_NslipSystem(1:f-1_pInt,structID)) ! at which index starts my family
@ -1804,11 +1816,11 @@ function constitutive_dislotwin_postResults(Tstar_v,Temperature,state,ipc,ip,el)
endif
enddo ; enddo
c = c + ns
case ('sb_eigenvalues')
case (sb_eigenvalues_ID)
forall (j = 1_pInt:3_pInt) &
constitutive_dislotwin_postResults(c+j) = eigValues(j)
c = c + 3_pInt
case ('sb_eigenvectors')
case (sb_eigenvectors_ID)
constitutive_dislotwin_postResults(c+1_pInt:c+9_pInt) = reshape(eigVectors,[9])
c = c + 9_pInt
end select

8
code/homogenization_isostrain.f90
View File

@ -40,7 +40,7 @@ module homogenization_isostrain
integer(pInt), dimension(:), allocatable, private :: &
homogenization_isostrain_Ngrains
enum, bind(c)
enumerator :: ncomponents, &
enumerator :: nconstituents, &
temperature, &
ipcoords, &
avgdefgrad, &
@ -48,7 +48,7 @@ module homogenization_isostrain
enumerator :: parallel, &
average
end enum
integer(kind(ncomponents)), dimension(:,:), allocatable, private :: &
integer(kind(nconstituents)), dimension(:,:), allocatable, private :: &
homogenization_isostrain_outputID !< ID of each post result output
integer(kind(average)), dimension(:), allocatable, private :: &
homogenization_isostrain_mapping !< ID of each post result output
@ -133,7 +133,7 @@ subroutine homogenization_isostrain_init(myUnit)
output = output + 1_pInt
homogenization_isostrain_output(output,i) = IO_lc(IO_stringValue(line,positions,2_pInt))
select case(homogenization_isostrain_output(output,i))
case('ngrains','ncomponents')
case('nconstituents','ngrains')
homogenization_isostrain_outputID(output,i) = ncomponents
case('temperature')
homogenization_isostrain_outputID(output,i) = temperature
@ -146,7 +146,7 @@ subroutine homogenization_isostrain_init(myUnit)
case default
mySize = 0_pInt
end select
case ('ngrains','ncomponents')
case ('nconstituents','ngrains')
homogenization_isostrain_Ngrains(i) = IO_intValue(line,positions,2_pInt)
case ('mapping')
select case(IO_lc(IO_stringValue(line,positions,2_pInt)))

2
code/material.f90
View File

@ -339,7 +339,7 @@ subroutine material_parseHomogenization(myFile,myPart)
end select
homogenization_typeInstance(section) = &
count(homogenization_type==homogenization_type(section)) ! count instances
case ('ngrains')
case ('nconstituents','ngrains')
homogenization_Ngrains(section) = IO_intValue(line,positions,2_pInt)
end select
endif