using a function for state update
avoids a lot of code repetition
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@ -1647,73 +1647,8 @@ subroutine integrateStateFPI()
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! --- DOT STATES ---
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!$OMP PARALLEL
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!$OMP DO
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e)) &
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call constitutive_collectDotState(crystallite_Tstar_v(1:6,g,i,e), &
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crystallite_Fe, &
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crystallite_Fi(1:3,1:3,g,i,e), &
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crystallite_Fp, &
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crystallite_subdt(g,i,e), crystallite_subFrac, g,i,e)
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enddo; enddo; enddo
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!$OMP ENDDO
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!$OMP DO PRIVATE(p,c,NaN)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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!$OMP FLUSH(crystallite_todo)
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if (crystallite_todo(g,i,e)) then
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p = phaseAt(g,i,e)
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c = phasememberAt(g,i,e)
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NaN = any(IEEE_is_NaN(plasticState(p)%dotState(:,c)))
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do mySource = 1_pInt, phase_Nsources(p)
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NaN = NaN .or. any(IEEE_is_NaN(sourceState(p)%p(mySource)%dotState(:,c)))
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enddo
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if (NaN) then ! NaN occured in any dotState
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#ifdef DEBUG
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if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt) &
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write(6,*) '<< CRYST >> dotstate ',plasticState(p)%dotState(:,c)
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#endif
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if (.not. crystallite_localPlasticity(g,i,e)) then ! if broken is a non-local...
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!$OMP CRITICAL (checkTodo)
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crystallite_todo = crystallite_todo .and. crystallite_localPlasticity ! ...all non-locals done (and broken)
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!$OMP END CRITICAL (checkTodo)
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else ! broken one was local...
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crystallite_todo(g,i,e) = .false. ! ... done (and broken)
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endif
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endif
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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! --- UPDATE STATE ---
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#ifdef DEBUG
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if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt) &
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write(6,'(a,i8,a)') '<< CRYST >> ', count(crystallite_todo(:,:,:)),' grains todo after preguess of state'
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#endif
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,c)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e)) then
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p = phaseAt(g,i,e)
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c = phasememberAt(g,i,e)
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mySizePlasticDotState = plasticState(p)%sizeDotState
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plasticState(p)%state(1:mySizePlasticDotState,c) = &
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plasticState(p)%subState0(1:mySizePlasticDotState,c) &
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+ plasticState(p)%dotState (1:mySizePlasticDotState,c) &
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* crystallite_subdt(g,i,e)
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do mySource = 1_pInt, phase_Nsources(p)
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mySizeSourceDotState = sourceState(p)%p(mySource)%sizeDotState
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sourceState(p)%p(mySource)%state(1:mySizeSourceDotState,c) = &
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sourceState(p)%p(mySource)%subState0(1:mySizeSourceDotState,c) &
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+ sourceState(p)%p(mySource)%dotState (1:mySizeSourceDotState,c) &
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* crystallite_subdt(g,i,e)
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enddo
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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!$OMP END PARALLEL
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call update_dotState(1.0_pReal)
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call update_state(1.0_pReal)
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! --+>> STATE LOOP <<+--
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@ -2016,43 +1951,11 @@ eIter = FEsolving_execElem(1:2)
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singleRun = (eIter(1) == eIter(2) .and. iIter(1,eIter(1)) == iIter(2,eIter(2)))
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call update_dotState(1.0_pReal)
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call update_State(1.0_pReal)
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!$OMP PARALLEL
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! --- UPDATE STATE ---
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,c)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e) .and. .not. crystallite_converged(g,i,e)) then
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p = phaseAt(g,i,e)
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c = phasememberAt(g,i,e)
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mySizePlasticDotState = plasticState(p)%sizeDotState
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plasticState(p)%state( 1:mySizePlasticDotState,c) = &
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plasticState(p)%subState0( 1:mySizePlasticDotState,c) &
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+ plasticState(p)%dotState(1:mySizePlasticDotState,c) &
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* crystallite_subdt(g,i,e)
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do mySource = 1_pInt, phase_Nsources(p)
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mySizeSourceDotState = sourceState(p)%p(mySource)%sizeDotState
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sourceState(p)%p(mySource)%state( 1:mySizeSourceDotState,c) = &
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sourceState(p)%p(mySource)%subState0( 1:mySizeSourceDotState,c) &
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+ sourceState(p)%p(mySource)%dotState(1:mySizeSourceDotState,c) &
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* crystallite_subdt(g,i,e)
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enddo
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#ifdef DEBUG
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if (iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt &
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.and. ((e == debug_e .and. i == debug_i .and. g == debug_g) &
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.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then
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p = phaseAt(g,i,e)
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c = phasememberAt(g,i,e)
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write(6,'(a,i8,1x,i2,1x,i3,/)') '<< CRYST >> update state at el ip g ',e,i,g
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write(6,'(a,/,(12x,12(e12.5,1x)),/)') '<< CRYST >> dotState', plasticState(p)%dotState(1:mySizePlasticDotState,c)
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write(6,'(a,/,(12x,12(e12.5,1x)),/)') '<< CRYST >> new state', plasticState(p)%state (1:mySizePlasticDotState,c)
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endif
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#endif
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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! --- STATE JUMP ---
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@ -2523,42 +2426,11 @@ subroutine integrateStateRK4()
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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!$OMP END PARALLEL
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,c)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e)) then
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p = phaseAt(g,i,e)
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c = phasememberAt(g,i,e)
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mySizePlasticDotState = plasticState(p)%sizeDotState
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plasticState(p)%state (1:mySizePlasticDotState,c) = &
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plasticState(p)%subState0(1:mySizePlasticDotState,c) &
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+ plasticState(p)%dotState (1:mySizePlasticDotState,c) &
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* crystallite_subdt(g,i,e) * timeStepFraction(n)
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do mySource = 1_pInt, phase_Nsources(p)
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mySizeSourceDotState = sourceState(p)%p(mySource)%sizeDotState
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sourceState(p)%p(mySource)%state (1:mySizeSourceDotState,c) = &
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sourceState(p)%p(mySource)%subState0(1:mySizeSourceDotState,c) &
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+ sourceState(p)%p(mySource)%dotState (1:mySizeSourceDotState,c) &
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* crystallite_subdt(g,i,e) * timeStepFraction(n)
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enddo
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#ifdef DEBUG
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if (n == 4 &
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.and. iand(debug_level(debug_crystallite), debug_levelExtensive) /= 0_pInt &
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.and. ((e == debug_e .and. i == debug_i .and. g == debug_g) &
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.or. .not. iand(debug_level(debug_crystallite), debug_levelSelective) /= 0_pInt)) then ! final integration step
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write(6,'(a,i8,1x,i2,1x,i3,/)') '<< CRYST >> updateState at el ip g ',e,i,g
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write(6,'(a,/,(12x,12(e12.5,1x)),/)') '<< CRYST >> dotState', plasticState(p)%dotState(1:mySizePlasticDotState,c)
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write(6,'(a,/,(12x,12(e12.5,1x)),/)') '<< CRYST >> new state', plasticState(p)%state(1:mySizePlasticDotState,c)
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endif
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#endif
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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call update_state(TIMESTEPFRACTION(n))
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!$OMP PARALLEL
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! --- state jump ---
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!$OMP DO
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@ -2784,27 +2656,11 @@ subroutine integrateStateRKCK45()
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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!$OMP END PARALLEL
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,cc)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e)) then
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p = phaseAt(g,i,e)
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cc = phasememberAt(g,i,e)
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mySizePlasticDotState = plasticState(p)%sizeDotState
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plasticState (p)%state (1:mySizePlasticDotState, cc) = &
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plasticState (p)%subState0(1:mySizePlasticDotState, cc) &
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+ plasticState (p)%dotState (1:mySizePlasticDotState, cc) &
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* crystallite_subdt(g,i,e)
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do mySource = 1_pInt, phase_Nsources(p)
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mySizeSourceDotState = sourceState(p)%p(mySource)%sizeDotState
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sourceState(p)%p(mySource)%state (1:mySizeSourceDotState,cc) = &
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sourceState(p)%p(mySource)%subState0(1:mySizeSourceDotState,cc) &
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+ sourceState(p)%p(mySource)%dotState (1:mySizeSourceDotState,cc) &
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* crystallite_subdt(g,i,e)
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enddo
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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call update_state(1.0_pReal) !MD: 1.0 correct?
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!$OMP PARALLEL
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! --- state jump ---
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@ -2908,31 +2764,11 @@ subroutine integrateStateRKCK45()
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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!$OMP END PARALLEL
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! --- state and update ---
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,cc)
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do e = eIter(1),eIter(2); do i = iIter(1,e),iIter(2,e); do g = gIter(1,e),gIter(2,e) ! iterate over elements, ips and grains
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if (crystallite_todo(g,i,e)) then
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p = phaseAt(g,i,e)
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cc = phasememberAt(g,i,e)
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mySizePlasticDotState = plasticState(p)%sizeDotState
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plasticState(p)%state (1:mySizePlasticDotState,cc) = &
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plasticState(p)%subState0(1:mySizePlasticDotState,cc) &
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+ plasticState(p)%dotState (1:mySizePlasticDotState,cc) &
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* crystallite_subdt(g,i,e)
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do mySource = 1_pInt, phase_Nsources(p)
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mySizeSourceDotState = sourceState(p)%p(mySource)%sizeDotState
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sourceState(p)%p(mySource)%state (1:mySizeSourceDotState,cc) = &
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sourceState(p)%p(mySource)%subState0(1:mySizeSourceDotState,cc) &
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+ sourceState(p)%p(mySource)%dotState (1:mySizeSourceDotState,cc)&
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* crystallite_subdt(g,i,e)
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enddo
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endif
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enddo; enddo; enddo
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!$OMP ENDDO
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call update_state(1.0_pReal)
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!$OMP PARALLEL
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! --- relative residui and state convergence ---
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!$OMP DO PRIVATE(mySizePlasticDotState,mySizeSourceDotState,p,cc,s)
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@ -3055,6 +2891,52 @@ subroutine integrateStateRKCK45()
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end subroutine integrateStateRKCK45
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!--------------------------------------------------------------------------------------------------
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!> @brief Standard forwarding of state as state = state0 + dotState * (delta t)
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!--------------------------------------------------------------------------------------------------
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subroutine update_state(timeFraction)
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use material, only: &
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plasticState, &
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sourceState, &
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phase_Nsources, &
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phaseAt, phasememberAt
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implicit none
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real(pReal), intent(in) :: &
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timeFraction
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integer(pInt) :: &
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e, & !< element index in element loop
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i, & !< integration point index in ip loop
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g, & !< grain index in grain loop
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p, &
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c, &
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s, &
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mySize
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!$OMP PARALLEL DO PRIVATE(mySize,p,c)
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do e = FEsolving_execElem(1),FEsolving_execElem(2)
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do i = FEsolving_execIP(1,e),FEsolving_execIP(2,e)
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do g = 1,homogenization_Ngrains(mesh_element(3,e))
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if (crystallite_todo(g,i,e) .and. .not. crystallite_converged(g,i,e)) then
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p = phaseAt(g,i,e); c = phasememberAt(g,i,e)
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mySize = plasticState(p)%sizeDotState
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plasticState(p)%state(1:mySize,c) = plasticState(p)%subState0(1:mySize,c) &
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+ plasticState(p)%dotState (1:mySize,c) &
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* crystallite_subdt(g,i,e) * timeFraction
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do s = 1_pInt, phase_Nsources(p)
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mySize = sourceState(p)%p(s)%sizeDotState
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sourceState(p)%p(s)%state(1:mySize,c) = sourceState(p)%p(s)%subState0(1:mySize,c) &
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+ sourceState(p)%p(s)%dotState (1:mySize,c) &
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* crystallite_subdt(g,i,e) * timeFraction
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enddo
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endif
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enddo; enddo; enddo
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!$OMP END PARALLEL DO
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end subroutine update_state
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!--------------------------------------------------------------------------------------------------
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!> @brief triggers calculation of all new rates
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!> if NaN occurs, crystallite_todo is set to FALSE. Any NaN in a nonlocal propagates to all others
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