WIP: cleaned
no file reading getting rid of a number of obsolete dependencies
This commit is contained in:
Martin Diehl
parent
e7268ce109
commit
194824fd0f
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@ -153,7 +153,7 @@ subroutine constitutive_init()
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! parse source mechanisms from config file
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call IO_checkAndRewind(FILEUNIT)
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if (any(phase_source == SOURCE_thermal_dissipation_ID)) call source_thermal_dissipation_init
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if (any(phase_source == SOURCE_thermal_externalheat_ID)) call source_thermal_externalheat_init(FILEUNIT)
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if (any(phase_source == SOURCE_thermal_externalheat_ID)) call source_thermal_externalheat_init
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if (any(phase_source == SOURCE_damage_isoBrittle_ID)) call source_damage_isoBrittle_init
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if (any(phase_source == SOURCE_damage_isoDuctile_ID)) call source_damage_isoDuctile_init
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if (any(phase_source == SOURCE_damage_anisoBrittle_ID)) call source_damage_anisoBrittle_init
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@ -248,7 +248,7 @@ subroutine crystallite_init
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allocate(crystallite_sizePostResult(maxval(crystallite_Noutput), &
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size(config_crystallite)), source=0_pInt)
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select case(numerics_integrator(1))
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select case(numerics_integrator)
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case(1_pInt)
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integrateState => integrateStateFPI
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case(2_pInt)
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@ -11,9 +11,12 @@ module kinematics_thermal_expansion
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implicit none
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private
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!type, private :: tParameters
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! real(pReal), allocatable, dimension(:) :: &
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!end type tParameters
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type, private :: tParameters
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real(pReal), allocatable, dimension(:,:,:) :: &
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expansion
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end type tParameters
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type(tParameters), dimension(:), allocatable :: param
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public :: &
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kinematics_thermal_expansion_init, &
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@ -28,17 +31,10 @@ contains
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!> @details reads in material parameters, allocates arrays, and does sanity checks
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!--------------------------------------------------------------------------------------------------
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subroutine kinematics_thermal_expansion_init()
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#if defined(__GFORTRAN__) || __INTEL_COMPILER >= 1800
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use, intrinsic :: iso_fortran_env, only: &
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compiler_version, &
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compiler_options
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#endif
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use debug, only: &
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debug_level,&
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debug_constitutive,&
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debug_levelBasic
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use IO, only: &
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IO_timeStamp
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use material, only: &
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phase_kinematics, &
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KINEMATICS_thermal_expansion_label, &
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@ -49,24 +45,38 @@ subroutine kinematics_thermal_expansion_init()
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implicit none
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integer(pInt) :: &
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Ninstance, &
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p
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p, i
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real(pReal), dimension(:), allocatable :: &
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temp
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write(6,'(/,a)') ' <<<+- kinematics_'//KINEMATICS_thermal_expansion_LABEL//' init -+>>>'
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write(6,'(a15,a)') ' Current time: ',IO_timeStamp()
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#include "compilation_info.f90"
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Ninstance = int(count(phase_kinematics == KINEMATICS_thermal_expansion_ID),pInt)
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if (Ninstance == 0_pInt) return
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if (iand(debug_level(debug_constitutive),debug_levelBasic) /= 0_pInt) &
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write(6,'(a16,1x,i5,/)') '# instances:',Ninstance
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allocate(param(Ninstance))
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do p = 1_pInt, size(phase_kinematics)
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if (all(phase_kinematics(:,p) /= KINEMATICS_thermal_expansion_ID)) cycle
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! ToDo: Here we need to decide how to extend the concept of instances to
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! kinetics and sources. I would suggest that the same mechanism exists at maximum once per phase
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! read up to three parameters (constant, linear, quadratic with T)
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temp = config_phase(p)%getFloats('thermal_expansion11')
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!lattice_thermalExpansion33(1,1,1:size(temp),p) = temp
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temp = config_phase(p)%getFloats('thermal_expansion22', &
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defaultVal=[(0.0_pReal, i=1,size(temp))],requiredSize=size(temp))
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!lattice_thermalExpansion33(2,2,1:size(temp),p) = temp
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temp = config_phase(p)%getFloats('thermal_expansion33', &
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defaultVal=[(0.0_pReal, i=1,size(temp))],requiredSize=size(temp))
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enddo
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end subroutine kinematics_thermal_expansion_init
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!--------------------------------------------------------------------------------------------------
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!> @brief report initial thermal strain based on current temperature deviation from reference
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!--------------------------------------------------------------------------------------------------
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@ -95,6 +105,7 @@ pure function kinematics_thermal_expansion_initialStrain(homog,phase,offset)
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end function kinematics_thermal_expansion_initialStrain
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!--------------------------------------------------------------------------------------------------
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!> @brief contains the constitutive equation for calculating the velocity gradient
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!--------------------------------------------------------------------------------------------------
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@ -921,7 +921,7 @@ subroutine material_allocatePlasticState(phase,NofMyPhase,&
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sizeState,sizeDotState,sizeDeltaState,&
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Nslip,Ntwin,Ntrans)
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use numerics, only: &
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numerics_integrator2 => numerics_integrator ! compatibility hack
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numerics_integrator
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implicit none
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integer(pInt), intent(in) :: &
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@ -933,8 +933,6 @@ subroutine material_allocatePlasticState(phase,NofMyPhase,&
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Nslip, &
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Ntwin, &
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Ntrans
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integer(pInt) :: numerics_integrator ! compatibility hack
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numerics_integrator = numerics_integrator2(1) ! compatibility hack
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plasticState(phase)%sizeState = sizeState
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plasticState(phase)%sizeDotState = sizeDotState
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@ -971,7 +969,7 @@ end subroutine material_allocatePlasticState
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subroutine material_allocateSourceState(phase,of,NofMyPhase,&
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sizeState,sizeDotState,sizeDeltaState)
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use numerics, only: &
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numerics_integrator2 => numerics_integrator ! compatibility hack
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numerics_integrator
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implicit none
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integer(pInt), intent(in) :: &
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@ -979,8 +977,6 @@ subroutine material_allocateSourceState(phase,of,NofMyPhase,&
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of, &
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NofMyPhase, &
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sizeState, sizeDotState,sizeDeltaState
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integer(pInt) :: numerics_integrator ! compatibility hack
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numerics_integrator = numerics_integrator2(1) ! compatibility hack
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sourceState(phase)%p(of)%sizeState = sizeState
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sourceState(phase)%p(of)%sizeDotState = sizeDotState
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@ -23,12 +23,10 @@ module numerics
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pert_method = 1_pInt, & !< method used in perturbation technique for tangent
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randomSeed = 0_pInt, & !< fixed seeding for pseudo-random number generator, Default 0: use random seed
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worldrank = 0_pInt, & !< MPI worldrank (/=0 for MPI simulations only)
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worldsize = 0_pInt !< MPI worldsize (/=0 for MPI simulations only)
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worldsize = 0_pInt, & !< MPI worldsize (/=0 for MPI simulations only)
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numerics_integrator = 1_pInt !< method used for state integration Default 1: fix-point iteration
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integer(4), protected, public :: &
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DAMASK_NumThreadsInt = 0 !< value stored in environment variable DAMASK_NUM_THREADS, set to zero if no OpenMP directive
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!< ToDo: numerics_integrator is an array for historical reasons, only element 1 is used!
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integer(pInt), dimension(2), protected, public :: &
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numerics_integrator = 1_pInt !< method used for state integration (central & perturbed state), Default 1: fix-point iteration for both states
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real(pReal), protected, public :: &
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relevantStrain = 1.0e-7_pReal, & !< strain increment considered significant (used by crystallite to determine whether strain inc is considered significant)
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defgradTolerance = 1.0e-7_pReal, & !< deviation of deformation gradient that is still allowed (used by CPFEM to determine outdated ffn1)
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@ -466,7 +464,7 @@ subroutine numerics_init
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write(6,'(a24,1x,es8.1)') ' rTol_crystalliteState: ',rTol_crystalliteState
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write(6,'(a24,1x,es8.1)') ' rTol_crystalliteStress: ',rTol_crystalliteStress
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write(6,'(a24,1x,es8.1)') ' aTol_crystalliteStress: ',aTol_crystalliteStress
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write(6,'(a24,2(1x,i8))') ' integrator: ',numerics_integrator
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write(6,'(a24,1x,i8)') ' integrator: ',numerics_integrator
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write(6,'(a24,1x,L8)') ' use ping pong scheme: ',usepingpong
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write(6,'(a24,1x,es8.1,/)')' unitlength: ',numerics_unitlength
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@ -589,7 +587,7 @@ subroutine numerics_init
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if (rTol_crystalliteState <= 0.0_pReal) call IO_error(301_pInt,ext_msg='rTol_crystalliteState')
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if (rTol_crystalliteStress <= 0.0_pReal) call IO_error(301_pInt,ext_msg='rTol_crystalliteStress')
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if (aTol_crystalliteStress <= 0.0_pReal) call IO_error(301_pInt,ext_msg='aTol_crystalliteStress')
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if (any(numerics_integrator <= 0_pInt) .or. any(numerics_integrator >= 6_pInt)) &
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if (numerics_integrator <= 0_pInt .or. numerics_integrator >= 6_pInt) &
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call IO_error(301_pInt,ext_msg='integrator')
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if (numerics_unitlength <= 0.0_pReal) call IO_error(301_pInt,ext_msg='unitlength')
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if (absTol_RGC <= 0.0_pReal) call IO_error(301_pInt,ext_msg='absTol_RGC')
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@ -1,4 +1,5 @@
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!--------------------------------------------------------------------------------------------------
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!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
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!> @author Pratheek Shanthraj, Max-Planck-Institut für Eisenforschung GmbH
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!> @brief material subroutine for thermal source due to plastic dissipation
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!> @details to be done
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@ -1,8 +1,8 @@
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!--------------------------------------------------------------------------------------------------
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!> @author Martin Diehl, Max-Planck-Institut für Eisenforschung GmbH
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!> @author Pratheek Shanthraj, Max-Planck-Institut für Eisenforschung GmbH
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!> @author Philip Eisenlohr, Michigan State University
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!> @brief material subroutine for variable heat source
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!> @details to be done
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!--------------------------------------------------------------------------------------------------
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module source_thermal_externalheat
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use prec, only: &
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@ -12,7 +12,6 @@ module source_thermal_externalheat
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implicit none
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private
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integer(pInt), dimension(:), allocatable, public, protected :: &
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source_thermal_externalheat_sizePostResults, & !< cumulative size of post results
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source_thermal_externalheat_offset, & !< which source is my current thermal dissipation mechanism?
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source_thermal_externalheat_instance !< instance of thermal dissipation source mechanism
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@ -25,20 +24,12 @@ module source_thermal_externalheat
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integer(pInt), dimension(:), allocatable, target, public :: &
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source_thermal_externalheat_Noutput !< number of outputs per instance of this source
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integer(pInt), dimension(:), allocatable, private :: &
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source_thermal_externalheat_nIntervals
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real(pReal), dimension(:,:), allocatable, private :: &
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source_thermal_externalheat_time, &
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source_thermal_externalheat_rate
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type, private :: tParameters !< container type for internal constitutive parameters
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real(pReal), dimension(:), allocatable :: &
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time, &
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rate
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heat_rate
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integer(pInt) :: &
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nInterval
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nIntervals
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end type tParameters
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type(tParameters), dimension(:), allocatable, private :: param !< containers of constitutive parameters (len Ninstance)
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@ -56,48 +47,29 @@ contains
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!> @brief module initialization
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!> @details reads in material parameters, allocates arrays, and does sanity checks
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!--------------------------------------------------------------------------------------------------
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subroutine source_thermal_externalheat_init(fileUnit)
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subroutine source_thermal_externalheat_init
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use debug, only: &
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debug_level,&
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debug_constitutive,&
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debug_levelBasic
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use IO, only: &
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IO_read, &
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IO_lc, &
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IO_getTag, &
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IO_isBlank, &
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IO_stringPos, &
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IO_stringValue, &
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IO_floatValue, &
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IO_intValue, &
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IO_warning, &
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IO_error, &
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IO_EOF
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use material, only: &
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material_allocateSourceState, &
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material_phase, &
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phase_source, &
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phase_Nsources, &
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phase_Noutput, &
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SOURCE_thermal_externalheat_label, &
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SOURCE_thermal_externalheat_ID, &
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material_phase, &
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sourceState
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SOURCE_thermal_externalheat_ID
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use config, only: &
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config_phase, &
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material_Nphase, &
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MATERIAL_partPhase
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implicit none
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integer(pInt), intent(in) :: fileUnit
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integer(pInt), allocatable, dimension(:) :: chunkPos
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integer(pInt) :: maxNinstance,phase,instance,source,sourceOffset
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integer(pInt) :: sizeState, sizeDotState, sizeDeltaState
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integer(pInt) :: NofMyPhase,interval,p
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character(len=65536) :: &
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tag = '', &
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line = ''
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real(pReal), allocatable, dimension(:,:) :: temp_time, temp_rate
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real(pReal), allocatable, dimension(:) :: tempVar
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integer(pInt) :: maxNinstance,instance,source,sourceOffset
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integer(pInt) :: NofMyPhase,p
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write(6,'(/,a)') ' <<<+- source_'//SOURCE_thermal_externalheat_label//' init -+>>>'
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@ -109,90 +81,40 @@ subroutine source_thermal_externalheat_init(fileUnit)
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allocate(source_thermal_externalheat_offset(material_Nphase), source=0_pInt)
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allocate(source_thermal_externalheat_instance(material_Nphase), source=0_pInt)
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do phase = 1, material_Nphase
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source_thermal_externalheat_instance(phase) = count(phase_source(:,1:phase) == SOURCE_thermal_externalheat_ID)
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do source = 1, phase_Nsources(phase)
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if (phase_source(source,phase) == SOURCE_thermal_externalheat_ID) &
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source_thermal_externalheat_offset(phase) = source
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do p = 1, material_Nphase
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source_thermal_externalheat_instance(p) = count(phase_source(:,1:p) == SOURCE_thermal_externalheat_ID)
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do source = 1, phase_Nsources(p)
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if (phase_source(source,p) == SOURCE_thermal_externalheat_ID) &
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source_thermal_externalheat_offset(p) = source
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enddo
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enddo
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allocate(source_thermal_externalheat_sizePostResults(maxNinstance), source=0_pInt)
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allocate(source_thermal_externalheat_sizePostResult(maxval(phase_Noutput),maxNinstance),source=0_pInt)
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allocate(source_thermal_externalheat_output (maxval(phase_Noutput),maxNinstance))
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source_thermal_externalheat_output = ''
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allocate(source_thermal_externalheat_Noutput(maxNinstance), source=0_pInt)
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allocate(source_thermal_externalheat_nIntervals(maxNinstance), source=0_pInt)
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allocate(temp_time(maxNinstance,1000), source=0.0_pReal)
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allocate(temp_rate(maxNinstance,1000), source=0.0_pReal)
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allocate(param(maxNinstance))
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do p=1, size(config_phase)
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if (all(phase_source(:,p) /= SOURCE_thermal_externalheat_ID)) cycle
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instance = source_thermal_externalheat_instance(p)
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sourceOffset = source_thermal_externalheat_offset(p)
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NofMyPhase=count(material_phase==p)
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tempVar = config_phase(p)%getFloats('externalheat_time')
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param(instance)%nIntervals = size(tempVar) - 1_pInt
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param(instance)%time= tempVar
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tempVar = config_phase(p)%getFloats('externalheat_rate',requiredSize = size(tempVar))
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param(instance)%heat_rate = tempVar
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call material_allocateSourceState(p,sourceOffset,NofMyPhase,1_pInt,1_pInt,0_pInt)
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enddo
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rewind(fileUnit)
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phase = 0_pInt
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do while (trim(line) /= IO_EOF .and. IO_lc(IO_getTag(line,'<','>')) /= MATERIAL_partPhase) ! wind forward to <phase>
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line = IO_read(fileUnit)
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enddo
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parsingFile: do while (trim(line) /= IO_EOF) ! read through sections of phase part
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line = IO_read(fileUnit)
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if (IO_isBlank(line)) cycle ! skip empty lines
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if (IO_getTag(line,'<','>') /= '') then ! stop at next part
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line = IO_read(fileUnit, .true.) ! reset IO_read
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exit
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endif
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if (IO_getTag(line,'[',']') /= '') then ! next phase section
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phase = phase + 1_pInt ! advance phase section counter
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cycle ! skip to next line
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endif
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if (phase > 0_pInt ) then; if (any(phase_source(:,phase) == SOURCE_thermal_externalheat_ID)) then ! do not short-circuit here (.and. with next if statemen). It's not safe in Fortran
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instance = source_thermal_externalheat_instance(phase) ! which instance of my source is present phase
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chunkPos = IO_stringPos(line)
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tag = IO_lc(IO_stringValue(line,chunkPos,1_pInt)) ! extract key
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select case(tag)
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case ('externalheat_time','externalheat_rate')
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if (chunkPos(1) <= 2_pInt) &
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call IO_error(150_pInt,ext_msg=trim(tag)//' ('//SOURCE_thermal_externalheat_label//')')
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if ( source_thermal_externalheat_nIntervals(instance) > 0_pInt &
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.and. source_thermal_externalheat_nIntervals(instance) /= chunkPos(1) - 2_pInt) &
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call IO_error(150_pInt,ext_msg=trim(tag)//' ('//SOURCE_thermal_externalheat_label//')')
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source_thermal_externalheat_nIntervals(instance) = chunkPos(1) - 2_pInt
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do interval = 1, source_thermal_externalheat_nIntervals(instance) + 1_pInt
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select case(tag)
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case ('externalheat_time')
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temp_time(instance, interval) = IO_floatValue(line,chunkPos,1_pInt + interval)
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case ('externalheat_rate')
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temp_rate(instance, interval) = IO_floatValue(line,chunkPos,1_pInt + interval)
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end select
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enddo
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end select
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endif; endif
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enddo parsingFile
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allocate(source_thermal_externalheat_time(maxNinstance,maxval(source_thermal_externalheat_nIntervals)+1_pInt), source=0.0_pReal)
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allocate(source_thermal_externalheat_rate(maxNinstance,maxval(source_thermal_externalheat_nIntervals)+1_pInt), source=0.0_pReal)
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initializeInstances: do phase = 1_pInt, material_Nphase
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if (any(phase_source(:,phase) == SOURCE_thermal_externalheat_ID)) then
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NofMyPhase = count(material_phase==phase)
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instance = source_thermal_externalheat_instance(phase)
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sourceOffset = source_thermal_externalheat_offset(phase)
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source_thermal_externalheat_time(instance,1:source_thermal_externalheat_nIntervals(instance)+1_pInt) = &
|
||||
temp_time(instance,1:source_thermal_externalheat_nIntervals(instance)+1_pInt)
|
||||
source_thermal_externalheat_rate(instance,1:source_thermal_externalheat_nIntervals(instance)+1_pInt) = &
|
||||
temp_rate(instance,1:source_thermal_externalheat_nIntervals(instance)+1_pInt)
|
||||
|
||||
call material_allocateSourceState(phase,sourceOffset,NofMyPhase,1_pInt,1_pInt,0_pInt)
|
||||
|
||||
endif
|
||||
|
||||
enddo initializeInstances
|
||||
end subroutine source_thermal_externalheat_init
|
||||
|
||||
|
||||
|
|
@ -245,16 +167,16 @@ subroutine source_thermal_externalheat_getRateAndItsTangent(TDot, dTDot_dT, phas
|
|||
instance = source_thermal_externalheat_instance(phase)
|
||||
sourceOffset = source_thermal_externalheat_offset(phase)
|
||||
|
||||
do interval = 1, source_thermal_externalheat_nIntervals(instance) ! scan through all rate segments
|
||||
do interval = 1, param(instance)%nIntervals ! scan through all rate segments
|
||||
frac_time = (sourceState(phase)%p(sourceOffset)%state(1,constituent) - &
|
||||
source_thermal_externalheat_time(instance,interval)) / &
|
||||
(source_thermal_externalheat_time(instance,interval+1) - &
|
||||
source_thermal_externalheat_time(instance,interval)) ! fractional time within segment
|
||||
param(instance)%time(interval)) / &
|
||||
(param(instance)%time(interval+1) - &
|
||||
param(instance)%time(interval)) ! fractional time within segment
|
||||
if ( (frac_time < 0.0_pReal .and. interval == 1) &
|
||||
.or. (frac_time >= 1.0_pReal .and. interval == source_thermal_externalheat_nIntervals(instance)) &
|
||||
.or. (frac_time >= 1.0_pReal .and. interval == param(instance)%nIntervals) &
|
||||
.or. (frac_time >= 0.0_pReal .and. frac_time < 1.0_pReal) ) &
|
||||
TDot = source_thermal_externalheat_rate(instance,interval ) * (1.0_pReal - frac_time) + &
|
||||
source_thermal_externalheat_rate(instance,interval+1) * frac_time ! interpolate heat rate between segment boundaries...
|
||||
TDot = param(instance)%heat_rate(interval ) * (1.0_pReal - frac_time) + &
|
||||
param(instance)%heat_rate(interval+1) * frac_time ! interpolate heat rate between segment boundaries...
|
||||
! ...or extrapolate if outside of bounds
|
||||
enddo
|
||||
dTDot_dT = 0.0
|
||||
|
|
|
|||
|
|
@ -43,8 +43,6 @@ contains
|
|||
!> @details reads in material parameters, allocates arrays, and does sanity checks
|
||||
!--------------------------------------------------------------------------------------------------
|
||||
subroutine thermal_adiabatic_init
|
||||
use IO, only: &
|
||||
IO_error
|
||||
use material, only: &
|
||||
thermal_type, &
|
||||
thermal_typeInstance, &
|
||||
|
|
|
|||
|
|
@ -44,8 +44,6 @@ contains
|
|||
!> @details reads in material parameters, allocates arrays, and does sanity checks
|
||||
!--------------------------------------------------------------------------------------------------
|
||||
subroutine thermal_conduction_init
|
||||
use IO, only: &
|
||||
IO_error
|
||||
use material, only: &
|
||||
thermal_type, &
|
||||
thermal_typeInstance, &
|
||||
|
|
|
|||
Loading…
Reference in New Issue