[CP2K:4508] CP2K 2.0.4 compilation failed while testing libraries

Fahimeh Baftizadeh fahimeh.b... at googlemail.com
Wed Jul 31 17:18:54 CEST 2013


Thanks Michael,

This is after I modified the script and recompiled it. 

 -lgoto2 -L/home/fbafti/CODE/scalapack_installer_dir/lib/  -lscalapack 
-L/home/fbafti/CODE/fftw3/lib/ -lfftw3 -L/share/apps/math_libs/libint/lib/ 
-lderiv -lint -lstdc++ -lpthread
/home/fbafti/CODE/cp2k-2.4.0/makefiles/../lib/Linux-x86-64-gfortran/popt/libcp2k_dbcsr_lib.a(dbcsr_mm_stack.o): 
In function `__dbcsr_mm_stack_MOD_process_mm_stack_cpu':
dbcsr_mm_stack.F:(.text+0x2ceb): undefined reference to `smm_dnn_'
dbcsr_mm_stack.F:(.text+0x2d2c): undefined reference to `smm_dnn_'
dbcsr_mm_stack.F:(.text+0x2d65): undefined reference to `smm_dnn_'
dbcsr_mm_stack.F:(.text+0x2d97): undefined reference to `smm_dnn_'
collect2: error: ld returned 1 exit status
make[1]: *** 
[/home/fbafti/CODE/cp2k-2.4.0/makefiles/../exe/Linux-x86-64-gfortran/cp2k.popt] 
Error 1
make[1]: Leaving directory 
`/home/fbafti/CODE/cp2k-2.4.0/obj/Linux-x86-64-gfortran/popt'
make: *** [build] Error 2

The same as before!
What do you think?

Fahimeh


On Tuesday, July 30, 2013 12:38:00 PM UTC-4, Michael wrote:
>
> Hi, 
>
> On Tue, Jul 30, 2013 at 09:26:20AM -0700, Fahimeh Baftizadeh wrote: 
> > I have installed gcc, GotoBLAS, scalapack, Libint, openmpi and all other 
> > requirements. 
> > This is the arch file which I have modified according to my libraries 
> path: 
>
> [...] 
>
> > LIBS     = -L/home/fbafti/CODE/GotoBLAS2/libgoto2.so 
>
> I don't think this will work, the -L switch is to add directories to be 
> searched for libraries usually.   
>
> So maybe try "-L/home/fbafti/CODE/GotoBLAS2/ -lgoto2" or something. 
>
>
> Michael 
>
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