Changed configure scripts...

cmake/compilerflags.cmake

@@ -13,7 +13,6 @@ elseif(${CMAKE_Fortran_COMPILER_ID} MATCHES "PGI")
    set(CMAKE_Fortran_FLAGS "${CMAKE_Fortran_FLAGS} -mp -Mr8 -Mr8intrinsics  -Mcuda:kepler+ -ta:tesla:cuda7.5 -DUSE_STREAMS -DNUM_STREAMS=${N_STREAMS} -Minfo=accel -acc")
    set(CMAKE_Fortran_FLAGS_RELEASE "${CMAKE_Fortran_FLAGS_RELEASE} -fast -O3")
    set(CMAKE_Fortran_FLAGS_DEBUG "${CMAKE_Fortran_FLAGS_DEBUG} -C -traceback -O0 -g -Mchkstk -Mchkptr")
-   set(FLEUR_LIBRARIES ${FLEUR_LIBRARIES} "-lstdc++;-L$ENV{MKLROOT}/lib/intel64;-lmkl_scalapack_lp64;-lmkl_intel_lp64;-lmkl_pgi_thread;-lmkl_core;-lmkl_blacs_intelmpi_lp64")
 elseif(${CMAKE_Fortran_COMPILER_ID} MATCHES "XL")
    message("IBM/BG Fortran detected")
    set(CMAKE_Fortran_FLAGS "${CMAKE_Fortran_FLAGS} -qsmp=omp -qnosave -qarch=qp -qtune=qp -qrealsize=8 -qfixed -qsuppress=1520-022 -qessl") 
@@ -26,5 +25,5 @@ elseif(${CMAKE_Fortran_COMPILER_ID} MATCHES "GNU")
    message("gfortran detected")
    set(CMAKE_Fortran_FLAGS "${CMAKE_Fortran_FLAGS} -ffree-line-length-none -fopenmp -fdefault-real-8 ")
    set(CMAKE_Fortran_FLAGS_RELEASE "${CMAKE_Fortran_FLAGS_RELEASE} -O4")
-   set(CMAKE_Fortran_FLAGS_DEBUG "${CMAKE_Fortran_FLAGS_DEBUG} -O0 -g")
+   set(CMAKE_Fortran_FLAGS_DEBUG "${CMAKE_Fortran_FLAGS_DEBUG} -fdump-core -Wall -Wextra -Warray-temporaries  -fbacktrace -fcheck=all  -finit-real=nan -O0 -g")
 endif()

cmake/machines/JURECA/JURECAGPU.cmake

@@ -3,11 +3,10 @@ set(CMAKE_Fortran_COMPILER mpif90)
 set(CMAKE_C_COMPILER mpicc)
 #Add include pathes
 #set(CMAKE_C_FLAGS " -I$ENV{XML2_ROOT}/include")
+set(FLEUR_LIBRARIES "-lstdc++;-L$ENV{MKLROOT}/lib/intel64;-lmkl_scalapack_lp64;-lmkl_intel_lp64;-lmkl_pgi_thread;-lmkl_core;-lmkl_blacs_intelmpi_lp64"")
 if (ENV{MAGMA_ROOT})
 set(FLEUR_Fortran_FLAGS " -I$ENV{MAGMA_ROOT}/include")
-set(FLEUR_LIBRARIES "-L$ENV{MAGMA_ROOT}/lib;-lmagma")
+set(FLEUR_LIBRARIES "${FLEUR_LIBARIES};-L$ENV{MAGMA_ROOT}/lib;-lmagma")
 endif()
-#Linker Stuff
-#set(FLEUR_LIBRARIES "-L$ENV{XML2_ROOT}/lib;-lxml2;-lz;-L$ENV{MAGMA_ROOT}/lib;-lmagma")
 set(FLEUR_DEFINITIONS ${FLEUR_DEFINITIONS} "CPP_AIX")
 set(FLEUR_MPI_DEFINITIONS ${FLEUR_MPI_DEFINITIONS} "CPP_AIX")

configure.sh

@@ -20,7 +20,6 @@ then
   cmake/machines.sh in this case :-)
   
   In addition you can modify some environment variables:
-        FLEUR_NO_SERIAL     -- if defined no serial executables will be build
         FC                  -- name of Fortran compiler
         CC                  -- name of C compiler
         FLEUR_LIBRARIES     -- list of linker arguments i.e. '-L/lib;-lbla'