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WIP: report active slip systems to DADF5 

needs further work, currently an array of fixed length strings is
written while all single strings are of variable length type
This commit is contained in:
Martin Diehl 2021-07-24 22:51:57 +02:00
parent 59d09d708e
commit 71e17ba917
3 changed files with 65 additions and 21 deletions
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4
src/HDF5_utilities.f90
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@ -453,7 +453,6 @@ subroutine HDF5_addAttribute_str_array(loc_id,attrLabel,attrValue,path)
integer :: hdferr
logical :: attrExists
character(len=:), allocatable :: p
type(C_PTR) :: f_ptr
character(len=:), allocatable, dimension(:), target :: attrValue_
@ -483,8 +482,7 @@ subroutine HDF5_addAttribute_str_array(loc_id,attrLabel,attrValue,path)
endif
call h5acreate_by_name_f(loc_id,trim(p),trim(attrLabel),filetype_id,space_id,attr_id,hdferr)
if(hdferr < 0) error stop 'HDF5 error'
f_ptr = c_loc(attrValue_)
call h5awrite_f(attr_id, memtype_id, f_ptr, hdferr)
call h5awrite_f(attr_id, memtype_id, c_loc(attrValue_), hdferr)
if(hdferr < 0) error stop 'HDF5 error'
call h5tclose_f(memtype_id,hdferr)

24
src/phase_mechanical_plastic_phenopowerlaw.f90
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@ -42,6 +42,9 @@ submodule(phase:plastic) phenopowerlaw
nonSchmidActive = .false.
character(len=pStringLen), allocatable, dimension(:) :: &
output
character(len=:), allocatable, dimension(:) :: &
systems_sl, &
systems_tw
end type tParameters
type :: tPhenopowerlawState
@ -115,6 +118,7 @@ module function plastic_phenopowerlaw_init() result(myPlasticity)
N_sl = pl%get_as1dInt('N_sl',defaultVal=emptyIntArray)
prm%sum_N_sl = sum(abs(N_sl))
slipActive: if (prm%sum_N_sl > 0) then
prm%systems_sl = lattice_labels_slip(N_sl,phase_lattice(ph))
prm%P_sl = lattice_SchmidMatrix_slip(N_sl,phase_lattice(ph),phase_cOverA(ph))
if (phase_lattice(ph) == 'cI') then
@ -126,8 +130,7 @@ module function plastic_phenopowerlaw_init() result(myPlasticity)
prm%P_nS_pos = prm%P_sl
prm%P_nS_neg = prm%P_sl
endif
prm%h_sl_sl = lattice_interaction_SlipBySlip(N_sl,pl%get_as1dFloat('h_sl-sl'), &
phase_lattice(ph))
prm%h_sl_sl = lattice_interaction_SlipBySlip(N_sl,pl%get_as1dFloat('h_sl-sl'),phase_lattice(ph))
xi_0_sl = pl%get_as1dFloat('xi_0_sl', requiredSize=size(N_sl))
prm%xi_inf_sl = pl%get_as1dFloat('xi_inf_sl', requiredSize=size(N_sl))
@ -162,11 +165,10 @@ module function plastic_phenopowerlaw_init() result(myPlasticity)
N_tw = pl%get_as1dInt('N_tw', defaultVal=emptyIntArray)
prm%sum_N_tw = sum(abs(N_tw))
twinActive: if (prm%sum_N_tw > 0) then
prm%P_tw = lattice_SchmidMatrix_twin(N_tw,phase_lattice(ph),phase_cOverA(ph))
prm%h_tw_tw = lattice_interaction_TwinByTwin(N_tw,pl%get_as1dFloat('h_tw-tw'), &
phase_lattice(ph))
prm%gamma_char = lattice_characteristicShear_twin(N_tw,phase_lattice(ph),&
phase_cOverA(ph))
prm%systems_tw = lattice_labels_twin(N_tw,phase_lattice(ph))
prm%P_tw = lattice_SchmidMatrix_twin(N_tw,phase_lattice(ph),phase_cOverA(ph))
prm%h_tw_tw = lattice_interaction_TwinByTwin(N_tw,pl%get_as1dFloat('h_tw-tw'),phase_lattice(ph))
prm%gamma_char = lattice_characteristicShear_twin(N_tw,phase_lattice(ph),phase_cOverA(ph))
xi_0_tw = pl%get_as1dFloat('xi_0_tw',requiredSize=size(N_tw))
@ -377,11 +379,11 @@ module subroutine plastic_phenopowerlaw_results(ph,group)
select case(trim(prm%output(o)))
case('xi_sl')
if(prm%sum_N_sl>0) call results_writeDataset(stt%xi_sl,group,trim(prm%output(o)), &
'resistance against plastic slip','Pa')
call results_writeState_slip(stt%xi_sl,group,trim(prm%output(o)),prm%systems_sl, &
'resistance against plastic slip','Pa')
case('gamma_sl')
if(prm%sum_N_sl>0) call results_writeDataset(stt%gamma_sl,group,trim(prm%output(o)), &
'plastic shear','1')
call results_writeState_slip(stt%gamma_sl,group,trim(prm%output(o)),prm%systems_sl, &
'plastic shear','1')
case('xi_tw')
if(prm%sum_N_tw>0) call results_writeDataset(stt%xi_tw,group,trim(prm%output(o)), &

58
src/results.f90
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@ -34,10 +34,11 @@ module results
end interface results_writeDataset
interface results_addAttribute
module procedure results_addAttribute_real
module procedure results_addAttribute_int
module procedure results_addAttribute_str
module procedure results_addAttribute_int
module procedure results_addAttribute_real
module procedure results_addAttribute_str_array
module procedure results_addAttribute_int_array
module procedure results_addAttribute_real_array
end interface results_addAttribute
@ -52,6 +53,7 @@ module results
results_openGroup, &
results_closeGroup, &
results_writeDataset, &
results_writeState_slip, &
results_setLink, &
results_addAttribute, &
results_removeLink, &
@ -189,7 +191,7 @@ subroutine results_setLink(path,link)
end subroutine results_setLink
!--------------------------------------------------------------------------------------------------
!> @brief adds a string attribute to an object in the results file
!> @brief Add a string attribute to an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_str(attrLabel,attrValue,path)
@ -207,7 +209,7 @@ end subroutine results_addAttribute_str
!--------------------------------------------------------------------------------------------------
!> @brief adds an integer attribute an object in the results file
!> @brief Add an integer attribute an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_int(attrLabel,attrValue,path)
@ -226,7 +228,7 @@ end subroutine results_addAttribute_int
!--------------------------------------------------------------------------------------------------
!> @brief adds a real attribute an object in the results file
!> @brief Add a real attribute an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_real(attrLabel,attrValue,path)
@ -245,7 +247,26 @@ end subroutine results_addAttribute_real
!--------------------------------------------------------------------------------------------------
!> @brief adds an integer array attribute an object in the results file
!> @brief Add a string array attribute an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_str_array(attrLabel,attrValue,path)
character(len=*), intent(in) :: attrLabel
character(len=*), intent(in), dimension(:) :: attrValue
character(len=*), intent(in), optional :: path
if (present(path)) then
call HDF5_addAttribute(resultsFile,attrLabel, attrValue, path)
else
call HDF5_addAttribute(resultsFile,attrLabel, attrValue)
endif
end subroutine results_addAttribute_str_array
!--------------------------------------------------------------------------------------------------
!> @brief Add an integer array attribute an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_int_array(attrLabel,attrValue,path)
@ -264,7 +285,7 @@ end subroutine results_addAttribute_int_array
!--------------------------------------------------------------------------------------------------
!> @brief adds a real array attribute an object in the results file
!> @brief Add a real array attribute an object in the results file.
!--------------------------------------------------------------------------------------------------
subroutine results_addAttribute_real_array(attrLabel,attrValue,path)
@ -337,6 +358,29 @@ subroutine results_writeVectorDataset_real(dataset,group,label,description,SIuni
end subroutine results_writeVectorDataset_real
!--------------------------------------------------------------------------------------------------
!> @brief Store real vector dataset with associated metadata for slip
!--------------------------------------------------------------------------------------------------
subroutine results_writeState_slip(dataset,group,label,systems,description,SIunit)
character(len=*), intent(in) :: label,group,description,SIunit
real(pReal), intent(in), dimension(:,:) :: dataset
character(len=*), intent(in), dimension(:) :: systems
integer(HID_T) :: groupHandle
if (size(systems) == 0) return
groupHandle = results_openGroup(group)
call HDF5_write(dataset,groupHandle,label)
call executionStamp(group//'/'//label,description,SIunit)
call HDF5_addAttribute(resultsFile,'slip_systems',systems,group//'/'//label)
call HDF5_closeGroup(groupHandle)
end subroutine results_writeState_slip
!--------------------------------------------------------------------------------------------------
!> @brief Store real tensor dataset with associated metadata.
!> @details Data is transposed to compenstate transposed storage order.