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DAMASK_EICMD
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corrected syntax errors (long lines, line continuation by \) and logical mistake in mpie_cpfem_marc / abq_std which went unnoticed in ifort. Using SunStudio f90 surfaced those...

This commit is contained in:
Philip Eisenlohr 2010-08-03 23:47:00 +00:00
parent 2c4f5c37dc
commit 298cecbfec
11 changed files with 98 additions and 86 deletions
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4
code/FEsolving.f90
View File

@ -43,10 +43,10 @@
rewind(fileunit) rewind(fileunit)
do do
read (fileunit,'(a1024)',END=100) line read (fileunit,'(a1024)',END=100) line
positions = IO_stringPos(line,1) positions(1:1+2*1) = IO_stringPos(line,1)
if( IO_lc(IO_stringValue(line,positions,1)) == 'solver' ) then if( IO_lc(IO_stringValue(line,positions,1)) == 'solver' ) then
read (fileunit,'(a1024)',END=100) line ! Garbage line read (fileunit,'(a1024)',END=100) line ! Garbage line
positions = IO_stringPos(line,2) positions(1:1+2*2) = IO_stringPos(line,2)
symmetricSolver = (IO_intValue(line,positions,2) /= 1_pInt) symmetricSolver = (IO_intValue(line,positions,2) /= 1_pInt)
exit exit
endif endif

2
code/IO.f90
View File

@ -135,7 +135,7 @@ end function
use mpie_interface use mpie_interface
implicit none implicit none
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
character(len=*) relPath character(len=*) relPath
integer(pInt) unit integer(pInt) unit

16
code/constitutive_dislotwin.f90
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@ -920,7 +920,8 @@ do f = 1,lattice_maxNslipFamily ! loop over all
constitutive_dislotwin_v0PerSlipSystem(f,myInstance) constitutive_dislotwin_v0PerSlipSystem(f,myInstance)
!* Shear rates due to slip !* Shear rates due to slip
gdot_slip(j) = DotGamma0*exp(-BoltzmannRatio*(1-StressRatio_p)**constitutive_dislotwin_q(myInstance))*sign(1.0_pReal,tau_slip(j)) gdot_slip(j) = DotGamma0*exp(-BoltzmannRatio*(1-StressRatio_p)**constitutive_dislotwin_q(myInstance))*&
sign(1.0_pReal,tau_slip(j))
!* Derivatives of shear rates !* Derivatives of shear rates
dgdot_dtauslip(j) = & dgdot_dtauslip(j) = &
@ -1010,8 +1011,11 @@ use prec, only: pReal,pInt,p_vec
use math, only: pi use math, only: pi
use mesh, only: mesh_NcpElems, mesh_maxNips use mesh, only: mesh_NcpElems, mesh_maxNips
use material, only: homogenization_maxNgrains, material_phase, phase_constitutionInstance use material, only: homogenization_maxNgrains, material_phase, phase_constitutionInstance
use lattice, only: lattice_Sslip,lattice_Sslip_v,lattice_Stwin,lattice_Stwin_v,lattice_maxNslipFamily,lattice_maxNtwinFamily, & use lattice, only: lattice_Sslip,lattice_Sslip_v, &
lattice_NslipSystem,lattice_NtwinSystem,lattice_shearTwin lattice_Stwin,lattice_Stwin_v, &
lattice_maxNslipFamily,lattice_maxNtwinFamily, &
lattice_NslipSystem,lattice_NtwinSystem, &
lattice_shearTwin
implicit none implicit none
!* Input-Output variables !* Input-Output variables
@ -1029,7 +1033,8 @@ real(pReal), dimension(constitutive_dislotwin_totalNslip(phase_constitutionInsta
gdot_slip,tau_slip,DotRhoMultiplication,EdgeDipDistance,DotRhoEdgeEdgeAnnihilation,DotRhoEdgeDipAnnihilation,& gdot_slip,tau_slip,DotRhoMultiplication,EdgeDipDistance,DotRhoEdgeEdgeAnnihilation,DotRhoEdgeDipAnnihilation,&
ClimbVelocity,DotRhoEdgeDipClimb,DotRhoDipFormation ClimbVelocity,DotRhoEdgeDipClimb,DotRhoDipFormation
real(pReal), dimension(constitutive_dislotwin_totalNtwin(phase_constitutionInstance(material_phase(g,ip,el)))) :: gdot_twin,tau_twin real(pReal), dimension(constitutive_dislotwin_totalNtwin(phase_constitutionInstance(material_phase(g,ip,el)))) :: &
gdot_twin,tau_twin
!* Shortened notation !* Shortened notation
myInstance = phase_constitutionInstance(material_phase(g,ip,el)) myInstance = phase_constitutionInstance(material_phase(g,ip,el))
@ -1064,7 +1069,8 @@ do f = 1,lattice_maxNslipFamily ! loop over all
constitutive_dislotwin_v0PerSlipSystem(f,myInstance) constitutive_dislotwin_v0PerSlipSystem(f,myInstance)
!* Shear rates due to slip !* Shear rates due to slip
gdot_slip(j) = DotGamma0*exp(-BoltzmannRatio*(1-StressRatio_p)**constitutive_dislotwin_q(myInstance))*sign(1.0_pReal,tau_slip(j)) gdot_slip(j) = DotGamma0*exp(-BoltzmannRatio*(1-StressRatio_p)**constitutive_dislotwin_q(myInstance))*&
sign(1.0_pReal,tau_slip(j))
!* Multiplication !* Multiplication
DotRhoMultiplication(j) = abs(gdot_slip(j))/& DotRhoMultiplication(j) = abs(gdot_slip(j))/&

3
code/constitutive_titanmod.f90
View File

@ -1500,7 +1500,8 @@ do o = 1,phase_Noutput(material_phase(g,ip,el))
tau = dot_product(Tstar_v,lattice_Sslip_v(:,index_myFamily+i,myStructure)) tau = dot_product(Tstar_v,lattice_Sslip_v(:,index_myFamily+i,myStructure))
!* Stress ratios !* Stress ratios
StressRatio_p = (abs(tau)/state(g,ip,el)%p(5*ns+3*nt+j))**constitutive_titanmod_pe_PerSlipSystem(j,myInstance) StressRatio_p = (abs(tau)/state(g,ip,el)%p(5*ns+3*nt+j))**constitutive_titanmod_pe_PerSlipSystem(j,myInstance)
StressRatio_pminus1 = (abs(tau)/state(g,ip,el)%p(5*ns+3*nt+j))**(constitutive_titanmod_pe_PerSlipSystem(j,myInstance)-1.0_pReal) StressRatio_pminus1 = (abs(tau)/state(g,ip,el)%p(5*ns+3*nt+j))**&
(constitutive_titanmod_pe_PerSlipSystem(j,myInstance)-1.0_pReal)
!* Boltzmann ratio !* Boltzmann ratio
BoltzmannRatio = constitutive_titanmod_f0_PerSlipSystem(j,myInstance)/(kB*Temperature) BoltzmannRatio = constitutive_titanmod_f0_PerSlipSystem(j,myInstance)/(kB*Temperature)
!* Initial shear rates !* Initial shear rates

6
code/crystallite.f90
View File

@ -1436,7 +1436,8 @@ LpLoop: do
if (error) then if (error) then
if (verboseDebugger .and. selectiveDebugger) then if (verboseDebugger .and. selectiveDebugger) then
!$OMP CRITICAL (write2out) !$OMP CRITICAL (write2out)
write(6,'(a,i3,x,i2,x,i5,x,a,x,i3)') '::: integrateStress failed on dR/dLp inversion at ',g,i,e,' ; iteration ', NiterationStress write(6,'(a,i3,x,i2,x,i5,x,a,x,i3)') '::: integrateStress failed on dR/dLp inversion at ',g,i,e, &
' ; iteration ', NiterationStress
write(6,*) write(6,*)
write(6,'(a,/,9(9(e15.3,x)/))') 'dRdLp',dRdLp write(6,'(a,/,9(9(e15.3,x)/))') 'dRdLp',dRdLp
write(6,'(a,/,9(9(e15.3,x)/))') 'dLpdT_constitutive',dLpdT_constitutive write(6,'(a,/,9(9(e15.3,x)/))') 'dLpdT_constitutive',dLpdT_constitutive
@ -1469,7 +1470,8 @@ LpLoop: do
if (error) then if (error) then
if (verboseDebugger .and. selectiveDebugger) then if (verboseDebugger .and. selectiveDebugger) then
!$OMP CRITICAL (write2out) !$OMP CRITICAL (write2out)
write(6,'(a,i3,x,i2,x,i5,x,a,x,i3)') '::: integrateStress failed on invFp_new inversion at ',g,i,e,' ; iteration ', NiterationStress write(6,'(a,i3,x,i2,x,i5,x,a,x,i3)') '::: integrateStress failed on invFp_new inversion at ',g,i,e, &
' ; iteration ', NiterationStress
write(6,*) write(6,*)
write(6,'(a11,3(i3,x),/,3(3(f12.7,x)/))') 'invFp_new at ',g,i,e,invFp_new write(6,'(a11,3(i3,x),/,3(3(f12.7,x)/))') 'invFp_new at ',g,i,e,invFp_new
!$OMPEND CRITICAL (write2out) !$OMPEND CRITICAL (write2out)

4
code/homogenization_RGC.f90
View File

@ -476,7 +476,9 @@ function homogenization_RGC_updateState(&
state%p(3*nIntFaceTot+8) = maxval(abs(drelax))/dt state%p(3*nIntFaceTot+8) = maxval(abs(drelax))/dt
if (el == 1 .and. ip == 1) then if (el == 1 .and. ip == 1) then
write(6,'(x,a30,x,e14.8)')'Constitutive work: ',constitutiveWork write(6,'(x,a30,x,e14.8)')'Constitutive work: ',constitutiveWork
write(6,'(x,a30,3(x,e14.8))')'Magnitude mismatch: ',sum(NN(1,:))/dble(nGrain),sum(NN(2,:))/dble(nGrain),sum(NN(3,:))/dble(nGrain) write(6,'(x,a30,3(x,e14.8))')'Magnitude mismatch: ',sum(NN(1,:))/dble(nGrain), &
sum(NN(2,:))/dble(nGrain), &
sum(NN(3,:))/dble(nGrain)
write(6,'(x,a30,x,e14.8)')'Penalty energy: ',penaltyEnergy write(6,'(x,a30,x,e14.8)')'Penalty energy: ',penaltyEnergy
write(6,'(x,a30,x,e14.8)')'Volume discrepancy: ',volDiscrep write(6,'(x,a30,x,e14.8)')'Volume discrepancy: ',volDiscrep
write(6,*)'' write(6,*)''

20
code/mesh.f90
View File

@ -2006,7 +2006,7 @@ subroutine mesh_marc_count_cpSizes (unit)
rewind(unit) rewind(unit)
do do
read (unit,610,END=630) line read (unit,610,END=630) line
pos = IO_stringPos(line,1) pos = IO_stringPos(line,maxNchunks)
if( IO_lc(IO_stringValue(line,pos,1)) == 'connectivity' ) then if( IO_lc(IO_stringValue(line,pos,1)) == 'connectivity' ) then
read (unit,610,END=630) line ! Garbage line read (unit,610,END=630) line ! Garbage line
do i=1,mesh_Nelems ! read all elements do i=1,mesh_Nelems ! read all elements
@ -2060,7 +2060,7 @@ subroutine mesh_marc_count_cpSizes (unit)
rewind(unit) rewind(unit)
do do
read (unit,610,END=620) line read (unit,610,END=620) line
pos = IO_stringPos(line,2) pos = IO_stringPos(line,maxNchunks)
if ( IO_lc(IO_stringValue(line,pos,1)) == '*part' ) inPart = .true. if ( IO_lc(IO_stringValue(line,pos,1)) == '*part' ) inPart = .true.
if ( IO_lc(IO_stringValue(line,pos,1)) == '*end' .and. & if ( IO_lc(IO_stringValue(line,pos,1)) == '*end' .and. &
IO_lc(IO_stringValue(line,pos,2)) == 'part' ) inPart = .false. IO_lc(IO_stringValue(line,pos,2)) == 'part' ) inPart = .false.
@ -2348,7 +2348,7 @@ subroutine mesh_marc_count_cpSizes (unit)
do while (e < mesh_NcpElems) do while (e < mesh_NcpElems)
read(unit,'(a1024)',END=110) line read(unit,'(a1024)',END=110) line
if (IO_isBlank(line)) cycle ! skip empty lines if (IO_isBlank(line)) cycle ! skip empty lines
pos = IO_stringPos(line,1) pos(1:1+2*1) = IO_stringPos(line,1)
e = e+1 ! valid element entry e = e+1 ! valid element entry
mesh_element ( 1,e) = e ! FE id mesh_element ( 1,e) = e ! FE id
@ -2399,7 +2399,7 @@ subroutine mesh_marc_count_cpSizes (unit)
rewind(unit) rewind(unit)
do do
read (unit,610,END=620) line read (unit,610,END=620) line
pos = IO_stringPos(line,1) pos(1:1+2*1) = IO_stringPos(line,1)
if( IO_lc(IO_stringValue(line,pos,1)) == 'connectivity' ) then if( IO_lc(IO_stringValue(line,pos,1)) == 'connectivity' ) then
read (unit,610,END=620) line ! Garbage line read (unit,610,END=620) line ! Garbage line
do i = 1,mesh_Nelems do i = 1,mesh_Nelems
@ -2421,16 +2421,16 @@ subroutine mesh_marc_count_cpSizes (unit)
620 rewind(unit) ! just in case "initial state" apears before "connectivity" 620 rewind(unit) ! just in case "initial state" apears before "connectivity"
read (unit,610,END=620) line read (unit,610,END=620) line
do do
pos = IO_stringPos(line,2) pos(1:1+2*2) = IO_stringPos(line,2)
if( (IO_lc(IO_stringValue(line,pos,1)) == 'initial') .and. & if( (IO_lc(IO_stringValue(line,pos,1)) == 'initial') .and. &
(IO_lc(IO_stringValue(line,pos,2)) == 'state') ) then (IO_lc(IO_stringValue(line,pos,2)) == 'state') ) then
if (initialcondTableStyle == 2) read (unit,610,END=620) line ! read extra line for new style if (initialcondTableStyle == 2) read (unit,610,END=620) line ! read extra line for new style
read (unit,610,END=630) line ! read line with index of state var read (unit,610,END=630) line ! read line with index of state var
pos = IO_stringPos(line,1) pos(1:1+2*1) = IO_stringPos(line,1)
sv = IO_IntValue(line,pos,1) ! figure state variable index sv = IO_IntValue(line,pos,1) ! figure state variable index
if( (sv == 2).or.(sv == 3) ) then ! only state vars 2 and 3 of interest if( (sv == 2).or.(sv == 3) ) then ! only state vars 2 and 3 of interest
read (unit,610,END=620) line ! read line with value of state var read (unit,610,END=620) line ! read line with value of state var
pos = IO_stringPos(line,1) pos(1:1+2*1) = IO_stringPos(line,1)
do while (scan(IO_stringValue(line,pos,1),'+-',back=.true.)>1) ! is noEfloat value? do while (scan(IO_stringValue(line,pos,1),'+-',back=.true.)>1) ! is noEfloat value?
val = NINT(IO_fixedNoEFloatValue(line,(/0,20/),1)) ! state var's value val = NINT(IO_fixedNoEFloatValue(line,(/0,20/),1)) ! state var's value
mesh_maxValStateVar(sv-1) = max(val,mesh_maxValStateVar(sv-1)) ! remember max val of homogenization and microstructure index mesh_maxValStateVar(sv-1) = max(val,mesh_maxValStateVar(sv-1)) ! remember max val of homogenization and microstructure index
@ -2445,7 +2445,7 @@ subroutine mesh_marc_count_cpSizes (unit)
enddo enddo
if (initialcondTableStyle == 0) read (unit,610,END=620) line ! ignore IP range for old table style if (initialcondTableStyle == 0) read (unit,610,END=620) line ! ignore IP range for old table style
read (unit,610,END=630) line read (unit,610,END=630) line
pos = IO_stringPos(line,1) pos(1:1+2*1) = IO_stringPos(line,1)
enddo enddo
endif endif
else else
@ -2487,7 +2487,7 @@ subroutine mesh_marc_count_cpSizes (unit)
rewind(unit) rewind(unit)
do do
read (unit,610,END=620) line read (unit,610,END=620) line
pos = IO_stringPos(line,2) pos(1:1+2*2) = IO_stringPos(line,2)
if ( IO_lc(IO_stringValue(line,pos,1)) == '*part' ) inPart = .true. if ( IO_lc(IO_stringValue(line,pos,1)) == '*part' ) inPart = .true.
if ( IO_lc(IO_stringValue(line,pos,1)) == '*end' .and. & if ( IO_lc(IO_stringValue(line,pos,1)) == '*end' .and. &
IO_lc(IO_stringValue(line,pos,2)) == 'part' ) inPart = .false. IO_lc(IO_stringValue(line,pos,2)) == 'part' ) inPart = .false.
@ -2539,7 +2539,7 @@ subroutine mesh_marc_count_cpSizes (unit)
if (i <= mesh_Nmaterials) then ! found one? if (i <= mesh_Nmaterials) then ! found one?
elemSetName = mesh_mapMaterial(i) ! take corresponding elemSet elemSetName = mesh_mapMaterial(i) ! take corresponding elemSet
read (unit,610,END=630) line ! read homogenization and microstructure read (unit,610,END=630) line ! read homogenization and microstructure
pos = IO_stringPos(line,2) pos(1:1+2*2) = IO_stringPos(line,2)
homog = NINT(IO_floatValue(line,pos,1)) homog = NINT(IO_floatValue(line,pos,1))
micro = NINT(IO_floatValue(line,pos,2)) micro = NINT(IO_floatValue(line,pos,2))
do i = 1,mesh_NelemSets ! look thru all elemSet definitions do i = 1,mesh_NelemSets ! look thru all elemSet definitions

4
code/mpie_cpfem_abaqus_std.f
View File

@ -174,7 +174,7 @@ subroutine UMAT(STRESS,STATEV,DDSDDE,SSE,SPD,SCD,&
calcMode(npt,cp_en) = .not. calcMode(npt,cp_en) ! ping pong (calc <--> collect) calcMode(npt,cp_en) = .not. calcMode(npt,cp_en) ! ping pong (calc <--> collect)
if ( calcMode(npt,cp_en) ) then ! now calc if ( calcMode(npt,cp_en) ) then ! now calc
if ( lastMode .ne. calcMode(npt,cp_en) ) then ! first after ping pong if ( lastMode .neqv. calcMode(npt,cp_en) ) then ! first after ping pong
call debug_reset() ! resets debugging call debug_reset() ! resets debugging
outdatedFFN1 = .false. outdatedFFN1 = .false.
cycleCounter = cycleCounter + 1 cycleCounter = cycleCounter + 1
@ -186,7 +186,7 @@ subroutine UMAT(STRESS,STATEV,DDSDDE,SSE,SPD,SCD,&
computationMode = 2 ! plain calc computationMode = 2 ! plain calc
endif endif
else ! now collect else ! now collect
if ( lastMode .ne. calcMode(npt,cp_en) ) call debug_info() ! first after ping pong reports debugging if ( lastMode .neqv. calcMode(npt,cp_en) ) call debug_info() ! first after ping pong reports debugging
if ( lastIncConverged ) then if ( lastIncConverged ) then
lastIncConverged = .false. lastIncConverged = .false.
computationMode = 4 ! collect and backup Jacobian after convergence computationMode = 4 ! collect and backup Jacobian after convergence

8
code/mpie_cpfem_marc.f90
View File

@ -57,7 +57,7 @@ end subroutine
function getSolverWorkingDirectoryName() function getSolverWorkingDirectoryName()
implicit none implicit none
character(1024) getSolverWorkingDirectoryName, outName character(1024) getSolverWorkingDirectoryName, outName
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
getSolverWorkingDirectoryName='' getSolverWorkingDirectoryName=''
outName='' outName=''
@ -71,7 +71,7 @@ function getSolverJobName()
implicit none implicit none
character(1024) getSolverJobName, outName character(1024) getSolverJobName, outName
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
integer(pInt) extPos integer(pInt) extPos
getSolverJobName='' getSolverJobName=''
@ -262,7 +262,7 @@ subroutine hypela2(&
calcMode(nn,cp_en) = .not. calcMode(nn,cp_en) ! ping pong (calc <--> collect) calcMode(nn,cp_en) = .not. calcMode(nn,cp_en) ! ping pong (calc <--> collect)
if ( calcMode(nn,cp_en) ) then ! now calc if ( calcMode(nn,cp_en) ) then ! now calc
if ( lastMode .ne. calcMode(nn,cp_en) ) then ! first after ping pong if ( lastMode .neqv. calcMode(nn,cp_en) ) then ! first after ping pong
call debug_reset() ! resets debugging call debug_reset() ! resets debugging
outdatedFFN1 = .false. outdatedFFN1 = .false.
cycleCounter = cycleCounter + 1 cycleCounter = cycleCounter + 1
@ -274,7 +274,7 @@ subroutine hypela2(&
computationMode = 2 ! plain calc computationMode = 2 ! plain calc
endif endif
else ! now collect else ! now collect
if ( lastMode /= calcMode(nn,cp_en) ) call debug_info() ! first after ping pong reports debugging if ( lastMode .neqv. calcMode(nn,cp_en) ) call debug_info() ! first after ping pong reports debugging
if ( lastIncConverged ) then if ( lastIncConverged ) then
lastIncConverged = .false. lastIncConverged = .false.
computationMode = 4 ! collect and backup Jacobian after convergence computationMode = 4 ! collect and backup Jacobian after convergence

9
code/mpie_spectral.f90
View File

@ -55,7 +55,7 @@ function getSolverWorkingDirectoryName()
implicit none implicit none
character(len=1024) cwd,outname,getSolverWorkingDirectoryName character(len=1024) cwd,outname,getSolverWorkingDirectoryName
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
call getarg(2,outname) ! path to loadFile call getarg(2,outname) ! path to loadFile
@ -83,7 +83,7 @@ function getSolverJobName()
implicit none implicit none
character(1024) getSolverJobName, outName, cwd character(1024) getSolverJobName, outName, cwd
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
integer(pInt) posExt,posSep integer(pInt) posExt,posSep
getSolverJobName = '' getSolverJobName = ''
@ -119,9 +119,10 @@ function getLoadcaseName()
implicit none implicit none
character(len=1024) getLoadcaseName, outName, cwd character(len=1024) getLoadcaseName, outName, cwd
character(len=*), parameter :: pathSep = achar(47)//achar(92) ! /, \ character(len=*), parameter :: pathSep = achar(47)//achar(92) ! forward and backward slash
integer(pInt) posExt,posSep integer(pInt) posExt,posSep
posExt = 0 !not sure if its needed
posExt = 0 ! not sure if required
call getarg(2,getLoadcaseName) call getarg(2,getLoadcaseName)
posExt = scan(getLoadcaseName,'.',back=.true.) posExt = scan(getLoadcaseName,'.',back=.true.)