From 0a08d9eff0f2bb488e87ada62bd63be26d50aa9d Mon Sep 17 00:00:00 2001 From: Luc Hantcherli Date: Fri, 14 Mar 2008 16:23:08 +0000 Subject: [PATCH] Corrected errors from the last release of constitutive_dislo Changed parameter designation in mattex file --- trunk/constitutive_dislo.f90 | 153 +++++++++++++++++++---------------- trunk/mattex.mpie | 38 +++++---- 2 files changed, 106 insertions(+), 85 deletions(-) diff --git a/trunk/constitutive_dislo.f90 b/trunk/constitutive_dislo.f90 index 6196a69b6..4bf3cc72d 100644 --- a/trunk/constitutive_dislo.f90 +++ b/trunk/constitutive_dislo.f90 @@ -53,9 +53,9 @@ real(pReal), dimension(:) , allocatable :: material_Qedge real(pReal), dimension(:) , allocatable :: material_tau0 real(pReal), dimension(:) , allocatable :: material_GrainSize real(pReal), dimension(:) , allocatable :: material_StackSize -real(pReal), dimension(:) , allocatable :: material_twin_ref +real(pReal), dimension(:) , allocatable :: material_ActivationLength +real(pReal), dimension(:) , allocatable :: material_TwinSaturation real(pReal), dimension(:) , allocatable :: material_twin_res -real(pReal), dimension(:) , allocatable :: material_twin_sens real(pReal), dimension(:) , allocatable :: material_c1 real(pReal), dimension(:) , allocatable :: material_c2 real(pReal), dimension(:) , allocatable :: material_c3 @@ -63,6 +63,8 @@ real(pReal), dimension(:) , allocatable :: material_c4 real(pReal), dimension(:) , allocatable :: material_c5 real(pReal), dimension(:) , allocatable :: material_c6 real(pReal), dimension(:) , allocatable :: material_c7 +real(pReal), dimension(:) , allocatable :: material_c8 +real(pReal), dimension(:) , allocatable :: material_c9 real(pReal), dimension(:,:) , allocatable :: material_SlipIntCoeff !************************************ @@ -361,15 +363,15 @@ do while(.true.) case ('stack_size') material_StackSize(section)=IO_floatValue(line,positions,2) write(6,*) 'stack_size', material_StackSize(section) - case ('twin_reference') - material_twin_ref(section)=IO_floatValue(line,positions,2) - write(6,*) 'twin_reference', material_twin_ref(section) + case ('d_star') + material_ActivationLength(section)=IO_floatValue(line,positions,2) + write(6,*) 'activation length', material_ActivationLength(section) + case ('f_sat') + material_TwinSaturation(section)=IO_floatValue(line,positions,2) + write(6,*) 'twin saturation', material_TwinSaturation(section) case ('twin_resistance') material_twin_res(section)=IO_floatValue(line,positions,2) write(6,*) 'twin_resistance', material_twin_res(section) - case ('twin_sensitivity') - material_twin_sens(section)=IO_floatValue(line,positions,2) - write(6,*) 'twin_sensitivity', material_twin_sens(section) case ('c1') material_c1(section)=IO_floatValue(line,positions,2) write(6,*) 'c1', material_c1(section) @@ -391,6 +393,12 @@ do while(.true.) case ('c7') material_c7(section)=IO_floatValue(line,positions,2) write(6,*) 'c7', material_c7(section) + case ('c8') + material_c7(section)=IO_floatValue(line,positions,2) + write(6,*) 'c8', material_c8(section) + case ('c9') + material_c7(section)=IO_floatValue(line,positions,2) + write(6,*) 'c9', material_c9(section) end select endif endif @@ -544,16 +552,18 @@ allocate(material_Qedge(material_maxN)) ; mat allocate(material_tau0(material_maxN)) ; material_tau0=0.0_pReal allocate(material_GrainSize(material_maxN)) ; material_GrainSize=0.0_pReal allocate(material_StackSize(material_maxN)) ; material_StackSize=0.0_pReal -allocate(material_twin_ref(material_maxN)) ; material_twin_ref=0.0_pReal +allocate(material_ActivationLength(material_maxN)) ; material_ActivationLength=0.0_pReal +allocate(material_TwinSaturation(material_maxN)) ; material_TwinSaturation=0.0_pReal allocate(material_twin_res(material_maxN)) ; material_twin_res=0.0_pReal -allocate(material_twin_sens(material_maxN)) ; material_twin_sens=0.0_pReal allocate(material_c1(material_maxN)) ; material_c1=0.0_pReal allocate(material_c2(material_maxN)) ; material_c2=0.0_pReal allocate(material_c3(material_maxN)) ; material_c3=0.0_pReal allocate(material_c4(material_maxN)) ; material_c4=0.0_pReal allocate(material_c5(material_maxN)) ; material_c5=0.0_pReal -allocate(material_c6(material_maxN)) ; material_c5=0.0_pReal -allocate(material_c7(material_maxN)) ; material_c5=0.0_pReal +allocate(material_c6(material_maxN)) ; material_c6=0.0_pReal +allocate(material_c7(material_maxN)) ; material_c7=0.0_pReal +allocate(material_c8(material_maxN)) ; material_c8=0.0_pReal +allocate(material_c9(material_maxN)) ; material_c9=0.0_pReal allocate(texture_ODFfile(texture_maxN)) ; texture_ODFfile='' allocate(texture_Ngrains(texture_maxN)) ; texture_Ngrains=0_pInt allocate(texture_symmetry(texture_maxN)) ; texture_symmetry='' @@ -923,20 +933,20 @@ startIdxTwin = material_Nslip(matID) constitutive_rho_f=matmul(constitutive_Pforest (1:material_Nslip(matID),1:material_Nslip(matID),matID),state) constitutive_rho_p=matmul(constitutive_Pparallel(1:material_Nslip(matID),1:material_Nslip(matID),matID),state) do i=1,material_Nslip(matID) - constitutive_passing_stress(i)=material_tau0(matID)+material_c1(matID)*material_Gmod(matID)*material_bg(matID)*& - sqrt(constitutive_rho_p(i)) + constitutive_passing_stress(i) = material_tau0(matID)+material_c1(matID)*material_Gmod(matID)*material_bg(matID)*& + sqrt(constitutive_rho_p(i)) - constitutive_jump_width(i)=material_c2(matID)/sqrt(constitutive_rho_f(i)) + constitutive_jump_width(i) = material_c2(matID)/sqrt(constitutive_rho_f(i)) - constitutive_activation_volume(i)=material_c3(matID)*constitutive_jump_width(i)*material_bg(matID)**2.0_pReal + constitutive_activation_volume(i) = material_c3(matID)*constitutive_jump_width(i)*material_bg(matID)**2.0_pReal - constitutive_rho_m(i)=(2.0_pReal*kB*Tp*sqrt(constitutive_rho_p(i)))/& - (material_c1(matID)*material_c3(matID)*material_Gmod(matID)*constitutive_jump_width(i)*& - material_bg(matID)**3.0_pReal) + constitutive_rho_m(i) = (2.0_pReal*kB*Tp*sqrt(constitutive_rho_p(i)))/& + (material_c1(matID)*material_c3(matID)*material_Gmod(matID)*constitutive_jump_width(i)*& + material_bg(matID)**3.0_pReal) - constitutive_g0_slip(i)=constitutive_rho_m(i)*material_bg(matID)*attack_frequency*constitutive_jump_width(i)*& - exp(-(material_Qedge(matID)+constitutive_passing_stress(i)*constitutive_activation_volume(i))/& - (kB*Tp)) + constitutive_g0_slip(i) = constitutive_rho_m(i)*material_bg(matID)*attack_frequency*constitutive_jump_width(i)*& + exp(-(material_Qedge(matID)+constitutive_passing_stress(i)*constitutive_activation_volume(i))/& + (kB*Tp)) enddo !* Quantities derived from state - twin @@ -974,6 +984,7 @@ subroutine constitutive_LpAndItsTangent(Lp,dLp_dTstar,Tstar_v,state,Tp,ipc,ip,el !********************************************************************* use prec, only: pReal,pInt use crystal, only: crystal_Sslip,crystal_Sslip_v,crystal_Stwin,crystal_Stwin_v,crystal_TwinShear +use math, only: math_Plain3333to99 implicit none !* Definition of variables @@ -995,13 +1006,14 @@ Ftwin = sum(state((startIdxTwin+1):(startIdxTwin+material_Ntwin(matID)))) Lp = 0.0_pReal do i=1,material_Nslip(matID) constitutive_tau_slip(i)=dot_product(Tstar_v,crystal_Sslip_v(:,i,material_CrystalStructure(matID))) - if (abs(constitutive_tau_slip(i))constitutive_passing_stress(i)) then + constitutive_gdot_slip(i) = constitutive_g0_slip(i)*& + sinh((constitutive_tau_slip(i)*constitutive_activation_volume(i))/(kB*Tp)) + constitutive_dgdot_dtauslip(i) = (constitutive_g0_slip(i)*constitutive_activation_volume(i))/(kB*Tp)*& + cosh((constitutive_tau_slip(i)*constitutive_activation_volume(i))/(kB*Tp)) else - constitutive_gdot_slip(i)=constitutive_g0_slip(i)*sinh(constitutive_tau_slip(i)*constitutive_activation_volume(i)/kB/Tp) - constitutive_dgdot_dtauslip(i)=constitutive_g0_slip(i)*constitutive_activation_volume(i)/kB/Tp*& - cosh(constitutive_tau_slip(i)*constitutive_activation_volume(i)/kB/Tp) + constitutive_gdot_slip(i) = 0.0_pReal + constitutive_dgdot_dtauslip(i) = 0.0_pReal endif Lp=Lp+(1.0_pReal-Ftwin)*constitutive_gdot_slip(i)*crystal_Sslip(:,:,i,material_CrystalStructure(matID)) enddo @@ -1010,19 +1022,28 @@ enddo do i=1,material_Ntwin(matID) constitutive_tau_twin(i)=dot_product(Tstar_v,crystal_Stwin_v(:,i,material_CrystalStructure(matID))) if (constitutive_tau_twin(i)>0.0_pReal) then - constitutive_fdot_twin(i)=(1.0_pReal-Ftwin)*constitutive_twin_volume(i)*& - ((material_twin_ref(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal))/material_bg(matID))*& - sum(abs(constitutive_gdot_slip))*(constitutive_tau_twin(i)/material_twin_res(matID))**& - material_twin_sens(matID) - constitutive_dfdot_dtautwin(i)=(1.0_pReal-Ftwin)*constitutive_twin_volume(i)*& - ((material_twin_ref(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal))/material_bg(matID))*& - sum(abs(constitutive_gdot_slip))*(material_twin_sens(matID)/material_twin_res(matID))*& - (constitutive_tau_twin(i)/material_twin_res(matID))**(material_twin_sens(matID)-1.0_pReal) + constitutive_fdot_twin(i) = (material_TwinSaturation(matID)-Ftwin)*constitutive_twin_volume(i)*& + material_c8(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal)*& + (material_ActivationLength(matID)/material_bg(matID))*sum(abs(constitutive_gdot_slip))*& + exp(-((material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID))) + constitutive_dfdot_dtautwin(i) = (material_TwinSaturation(matID)-Ftwin)*constitutive_twin_volume(i)*& + material_c8(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal)*& + (material_ActivationLength(matID)/material_bg(matID))*sum(abs(constitutive_gdot_slip))*& + (material_c9(matID)/constitutive_tau_twin(i))*& + (material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID)*& + exp(-((material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID))) do j=1,material_Nslip(matID) - constitutive_dfdot_dtauslip(i,j)=(1.0_pReal-Ftwin)*constitutive_twin_volume(i)*& - ((material_twin_ref(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal))/material_bg(matID))*& - abs(constitutive_dgdot_dtauslip(j))*(constitutive_tau_twin(i)/material_twin_res(matID))**& - material_twin_sens(matID) + if (constitutive_gdot_slip(i)>0.0_pReal) then + constitutive_dfdot_dtauslip(i,j) = (material_TwinSaturation(matID)-Ftwin)*constitutive_twin_volume(i)*& + material_c8(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal)*& + (material_ActivationLength(matID)/material_bg(matID))*constitutive_dgdot_dtauslip(j)*& + exp(-((material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID))) + else + constitutive_dfdot_dtauslip(i,j) = (material_TwinSaturation(matID)-Ftwin)*constitutive_twin_volume(i)*& + material_c8(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal)*& + (material_ActivationLength(matID)/material_bg(matID))*(-constitutive_dgdot_dtauslip(j))*& + exp(-((material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID))) + endif enddo else constitutive_fdot_twin(i)=0.0_pReal @@ -1037,12 +1058,12 @@ enddo !* Calculation of the tangent of Lp -dLp_dTstar=0.0_pReal +dLp_dTstar3333=0.0_pReal do i=1,material_Nslip(matID) Sslip = crystal_Sslip(:,:,i,material_CrystalStructure(matID)) forall (k=1:3,l=1:3,m=1:3,n=1:3) dLp_dTstar3333(k,l,m,n) = dLp_dTstar3333(k,l,m,n)+ & - (1-Ftwin)*constitutive_dgdot_dtauslip(i)*Sslip(k,l)*(Sslip(m,n)+Sslip(n,m))/2.0_pReal !force m,n symmetry + (1.0_pReal-Ftwin)*constitutive_dgdot_dtauslip(i)*Sslip(k,l)*(Sslip(m,n)+Sslip(n,m))/2.0_pReal !force m,n symmetry endforall enddo do i=1,material_Ntwin(matID) @@ -1099,21 +1120,24 @@ startIdxTwin = material_Nslip(matID) !* Dislocation density evolution do i=1,material_Nslip(matID) constitutive_tau_slip(i)=dot_product(Tstar_v,crystal_Sslip_v(:,i,material_CrystalStructure(matID))) - if (abs(constitutive_tau_slip(i))constitutive_passing_stress(i)) then + constitutive_gdot_slip(i) = constitutive_g0_slip(i)*& + sinh((constitutive_tau_slip(i)*constitutive_activation_volume(i))/(kB*Tp)) else - constitutive_gdot_slip(i)=constitutive_g0_slip(i)*sinh(constitutive_tau_slip(i)*constitutive_activation_volume(i)/kB/Tp) + constitutive_gdot_slip(i) = 0.0_pReal endif - constitutive_locks(i)=(sqrt(constitutive_rho_f(i))*abs(constitutive_gdot_slip(i)))/(material_c4(matID)*material_bg(matID)) - constitutive_grainboundaries(i)=(abs(constitutive_gdot_slip(i)))/(material_c5(matID)*material_bg(matID)*& - material_GrainSize(matID)) - do j=1,material_Ntwin(matID) ! to not count twin hardening effect when no twinning (if maybe be used) - constitutive_twinboundaries(i)=(abs(constitutive_gdot_slip(i))*constitutive_inv_intertwin_len(i))/(material_c6(matID)*& - material_bg(matID)) - enddo - constitutive_recovery(i)=material_c7(matID)*state(i)*abs(constitutive_gdot_slip(i)) - constitutive_dotState(i)=constitutive_locks(i)+constitutive_grainboundaries(i)+constitutive_twinboundaries(i)-& - constitutive_recovery(i) + constitutive_locks(i) = (sqrt(constitutive_rho_f(i))*abs(constitutive_gdot_slip(i)))/& + (material_c4(matID)*material_bg(matID)) + constitutive_grainboundaries(i) = abs(constitutive_gdot_slip(i))/& + (material_c5(matID)*material_bg(matID)*material_GrainSize(matID)) + if (material_Ntwin(matID)>0) then + constitutive_twinboundaries(i) = (abs(constitutive_gdot_slip(i))*constitutive_inv_intertwin_len(i))/& + (material_c6(matID)*material_bg(matID)) + endif + constitutive_recovery(i) = material_c7(matID)*state(i)*abs(constitutive_gdot_slip(i)) + constitutive_dotState(i) = constitutive_locks(i)+constitutive_grainboundaries(i)+constitutive_twinboundaries(i)& + -constitutive_recovery(i) + enddo !* Twin volume fraction evolution @@ -1121,12 +1145,12 @@ Ftwin = sum(state((startIdxTwin+1):(startIdxTwin+material_Ntwin(matID)))) do i=1,material_Ntwin(matID) constitutive_tau_twin(i)=dot_product(Tstar_v,crystal_Stwin_v(:,i,material_CrystalStructure(matID))) if (constitutive_tau_twin(i)>0.0_pReal) then - constitutive_fdot_twin(i)=(1.0_pReal-Ftwin)*constitutive_twin_volume(i)*& - ((material_twin_ref(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal))/material_bg(matID))*& - sum(abs(constitutive_gdot_slip))*(constitutive_tau_twin(i)/material_twin_res(matID))**& - material_twin_sens(matID) + constitutive_fdot_twin(i) = (material_TwinSaturation(matID)-Ftwin)*constitutive_twin_volume(i)*& + material_c8(matID)*sum(state(1:material_Nslip(matID)))**(1.5_pReal)*& + (material_ActivationLength(matID)/material_bg(matID))*sum(abs(constitutive_gdot_slip))*& + exp(-((material_twin_res(matID)/constitutive_tau_twin(i))**material_c9(matID))) else - constitutive_fdot_twin(i)=0.0_pReal + constitutive_fdot_twin(i) = 0.0_pReal endif constitutive_dotState(startIdxTwin+i)=constitutive_fdot_twin(i) enddo @@ -1169,21 +1193,12 @@ if(constitutive_Nresults(ipc,ip,el)==0) return constitutive_post_results=0.0_pReal do i=1,material_Nslip(matID) constitutive_post_results(i) = state(i) -! tau_slip=dot_product(Tstar_v,crystal_Sslip_v(:,i,material_CrystalStructure(matID))) -! constitutive_post_results(i+material_Nslip(matID)) = & -! dt*constitutive_g0_slip(i)*sinh((abs(tau_slip)*constitutive_activation_volume(i))/(kB*Tp))*& -! sign(1.0_pReal,tau_slip) enddo do i=1,material_Ntwin(matID) constitutive_post_results(startIdxTwin+i) = state(startIdxTwin+i) -! tau_slip=dot_product(Tstar_v,crystal_Sslip_v(:,i,material_CrystalStructure(matID))) -! constitutive_post_results(i+material_Nslip(matID)) = & -! dt*constitutive_g0_slip(i)*sinh((abs(tau_slip)*constitutive_activation_volume(i))/(kB*Tp))*& -! sign(1.0_pReal,tau_slip) enddo return - end function END MODULE \ No newline at end of file diff --git a/trunk/mattex.mpie b/trunk/mattex.mpie index 7b4026cb1..10d3f756c 100644 --- a/trunk/mattex.mpie +++ b/trunk/mattex.mpie @@ -2,7 +2,7 @@ [TWIP steel FeMnC] crystal_structure 1 Nslip 12 -Ntwin 0 +Ntwin 12 ## Elastic constants # Unit in [Pa] C11 245.0e9 @@ -24,7 +24,7 @@ hardening_coefficients 1.0 1.4 # Initial dislocation density [m]² rho0 2.8e13 # Burgers vector [m] -burgers 2.86e-10 +burgers 2.56e-10 # Activation energy for dislocation glide [J/K] Qedge 3.0e-19 # Reference for passing stress [Pa] @@ -37,30 +37,36 @@ c2 2.0 c3 1.2 # Dislocation storage adjustment # = c4(Anxin)*c2(Anxin) !!!!!! -c4 14.29 +c4 14.25 +# Grain boundaries storage adjustment +c5 1.0 # Athermal annihilation adjustment -c7 20.0 +c7 23.5 # Dislocation interaction coefficients interaction_coefficients 1.0 2.2 3.0 1.6 3.8 4.5 # Twin parameters -# Grain boundaries storage adjustment -c5 1.0e100 -# Twin boundaries storage adjustment -c6 1.0e100 -# grain size, average size of stacks of twins [m] -grain_size 1.5e-5 +# Grain size [m] +grain_size 2.0e-5 +# Twin thickness (stacks) [m] stack_size 5.0e-8 -# stacking fault energy +# Activation length for twin nucleation [m] +d_star 5.0e-10 +# Twin saturation value +f_sat 0.3 +# Twin boundaries storage adjustment +c6 0.425 +# Scaling of really activated nucleation sites +c8 2.0e-3 +# Selection of active twin systems +c9 10.0 +# Twin resistance [Pa] +twin_resistance 1000.0e6 stacking_fault_energy 2.0e-2 -# Twin reference [?], twin resistance [Pa], twin sensitivity -twin_reference 1.0e-15 -twin_resistance 150.0e6 -twin_sensitivity 10.0 [cube SX] symmetry no /monoclinic /orthorhombic Ngrains 1 /2 /4 -(gauss) phi1 0.0 phi 45.0 phi2 0.0 scatter 0.0 fraction 1.0 +(gauss) phi1 0.0 phi 0.0 phi2 0.0 scatter 0.0 fraction 1.0