Merge remote-tracking branch 'origin/development' into 215_dependencies-in-setup.cfg

.github/workflows/Fortran.yml

@@ -2,7 +2,7 @@ name: Grid and Mesh Solver
 on: [push]
 
 env:
-  PETSC_VERSION: '3.17.4'
+  PETSC_VERSION: '3.18.0'
   HOMEBREW_NO_ANALYTICS: 'ON'     # Make Homebrew installation a little quicker
   HOMEBREW_NO_AUTO_UPDATE: 'ON'
   HOMEBREW_NO_BOTTLE_SOURCE_FALLBACK: 'ON'
@@ -158,7 +158,10 @@ jobs:
         if: contains( matrix.intel_v, 'classic')
         run: |
           cd petsc-${PETSC_VERSION}
-          ./configure --with-fc=mpiifort --with-cc="mpiicc -cc=icc" --with-cxx="mpiicpc -cxx=icpc" \
+          ./configure \
+          --with-fc='mpiifort -fc=ifort -diag-disable=10441' \
+          --with-cc='mpiicc -cc=icc -diag-disable=10441' \
+          --with-cxx='mpiicpc -cxx=icpc -diag-disable=10441' \
           --download-fftw --download-hdf5 --download-hdf5-fortran-bindings=1 --download-zlib
           make all
 
@@ -166,7 +169,10 @@ jobs:
         if: contains( matrix.intel_v, 'llvm')
         run: |
           cd petsc-${PETSC_VERSION}
-          ./configure --with-fc=mpiifort --with-cc="mpiicc -cc=icx" --with-cxx="mpiicpc -cxx=icpx" \
+          ./configure \
+          --with-fc='mpiifort -fc=ifx' \
+          --with-cc='mpiicc -cc=icx' \
+          --with-cxx='mpiicpc -cxx=icpx' \
           --download-fftw --download-hdf5 --download-hdf5-fortran-bindings=1 --download-zlib
           make all
 

PRIVATE

@@ -1 +1 @@
-Subproject commit 8c0a24006f355ce8d7602daa77a33348183a2bc7
+Subproject commit 583beecdcf806c5249574fd599f0b763f3461c3b

VERSION

@@ -1 +1 @@
-3.0.0-alpha7
+3.0.0-alpha7-16-g027d77e9f

src/CMakeLists.txt

@@ -2,6 +2,7 @@
 if(CMAKE_Fortran_COMPILER_ID STREQUAL "GNU")
     # long lines for interaction matrix
     set_source_files_properties("lattice.f90" PROPERTIES COMPILE_FLAGS "-ffree-line-length-240")
+    set_source_files_properties("parallelization.f90" PROPERTIES COMPILE_FLAGS "-ffree-line-length-none")
 endif()
 
 file(GLOB damask-sources CONFIGURE_DEPENDS *.f90 *.c)
@@ -18,7 +19,7 @@ foreach(solver-source ${solver-sources})
     file(READ ${solver-source} content)
     string(FIND "${content}" "CHKERR" found)
     if(NOT ${found} EQUAL -1)
-      set_source_files_properties(${solver-source} PROPERTIES COMPILE_FLAGS "-ffree-line-length-160")
+        set_source_files_properties(${solver-source} PROPERTIES COMPILE_FLAGS "-ffree-line-length-none")
     endif()
 endforeach()
 

src/grid/grid_thermal_spectral.f90

@@ -110,7 +110,7 @@ subroutine grid_thermal_spectral_init()
   T_current = discretization_grid_getInitialCondition('T')
   T_lastInc = T_current
   T_stagInc = T_current
-  dotT_lastInc = 0.0_pReal
+  dotT_lastInc = 0.0_pReal * T_current
 
 !--------------------------------------------------------------------------------------------------
 ! initialize solver specific parts of PETSc

src/phase_mechanical_plastic_phenopowerlaw.f90

@@ -347,8 +347,7 @@ module function phenopowerlaw_dotState(Mp,ph,en) result(dotState)
     sumF
   real(pReal), dimension(param(ph)%sum_N_sl) :: &
     dot_gamma_sl_pos,dot_gamma_sl_neg, &
-    right_SlipSlip
+    left_SlipSlip
-
 
   associate(prm => param(ph), stt => state(ph), &
             dot_xi_sl => dotState(indexDotState(ph)%xi_sl(1):indexDotState(ph)%xi_sl(2)), &
@@ -356,17 +355,17 @@ module function phenopowerlaw_dotState(Mp,ph,en) result(dotState)
             dot_gamma_sl => dotState(indexDotState(ph)%gamma_sl(1):indexDotState(ph)%gamma_sl(2)), &
             dot_gamma_tw => dotState(indexDotState(ph)%gamma_tw(1):indexDotState(ph)%gamma_tw(2)))
 
-    call kinetics_sl(Mp,ph,en,dot_gamma_sl_pos,dot_gamma_sl_neg)
+    call kinetics_sl(Mp,ph,en, dot_gamma_sl_pos,dot_gamma_sl_neg)
     dot_gamma_sl = abs(dot_gamma_sl_pos+dot_gamma_sl_neg)
-    call kinetics_tw(Mp,ph,en,dot_gamma_tw)
+    call kinetics_tw(Mp,ph,en, dot_gamma_tw)
-
     sumF = sum(stt%gamma_tw(:,en)/prm%gamma_char)
-    xi_sl_sat_offset = prm%f_sat_sl_tw*sqrt(sumF)
-    right_SlipSlip = sign(abs(1.0_pReal-stt%xi_sl(:,en) / (prm%xi_inf_sl+xi_sl_sat_offset))**prm%a_sl, &
-                          1.0_pReal-stt%xi_sl(:,en) / (prm%xi_inf_sl+xi_sl_sat_offset))
 
-    dot_xi_sl = prm%h_0_sl_sl * (1.0_pReal + prm%c_1*sumF** prm%c_2) * (1.0_pReal + prm%h_int) &
+    xi_sl_sat_offset = prm%f_sat_sl_tw*sqrt(sumF)
-                * matmul(prm%h_sl_sl,dot_gamma_sl*right_SlipSlip) &
+    left_SlipSlip = sign(abs(1.0_pReal-stt%xi_sl(:,en) / (prm%xi_inf_sl+xi_sl_sat_offset))**prm%a_sl, &
+                             1.0_pReal-stt%xi_sl(:,en) / (prm%xi_inf_sl+xi_sl_sat_offset))
+
+    dot_xi_sl = prm%h_0_sl_sl * (1.0_pReal + prm%c_1 * sumF**prm%c_2) * (1.0_pReal + prm%h_int) &
+                * left_SlipSlip * matmul(prm%h_sl_sl,dot_gamma_sl) &
               + matmul(prm%h_sl_tw,dot_gamma_tw)
 
     dot_xi_tw = prm%h_0_tw_sl * sum(stt%gamma_sl(:,en))**prm%c_3 &