[Wien] Compile linking errors

[Victor Zenou]

Compile linking errors_12062023

Sorry for my mistake. Here it is again.

I installed Wien2k_23.2 using gfortran on Ubuntu 22.04.2 LTS, using gavin’s
"*WIEN2k 23.2 Install with gfortran"**.*

When I checked file compile.msg in the corresponding SRC_* directory , I
saw that few of them had linking errors. For instance:


SRC_lapw0:

rm -f *.o *_tmp_.* *.P .sequential .parallel *.mod

if [ -f .parallel ]; then \

rm -f .parallel modules.o libxc_mod.o W2kinit.o fft_modules.o reallocate.o
energy.o finl_elect_str.o getff1.o getfft.o gtfnam.o lapw0.o outerr.o
rean_direct_fft.o rean0.o rean3.o rean4.o setff1.o setff2.o setfft.o
stress_gga.o xcpot1.o xcpot1Q.o xcpot3.o eramps.o inputpars.o *.mod; \

fi

touch .sequential

make ./lapw0 FORT=gfortran FFLAGS=' Compiler options=-ffree-form -O2
-ftree-vectorize -march=native -ffree-line-length-none -ffpe-summary=none
-fallow-argument-mismatch -DLIBXC -I/home/victor/libxc-6.1.0/include
-DFFTW3 -I/home/victor/fftw-3.3.10/include -fopenmp'

make[1]: Entering directory '/home/victor/WIEN2k23.1/SRC_lapw0'

gfortran Compiler options=-ffree-form -O2 -ftree-vectorize -march=native
-ffree-line-length-none -ffpe-summary=none -fallow-argument-mismatch
-DLIBXC -I/home/victor/libxc-6.1.0/include -DFFTW3
-I/home/victor/fftw-3.3.10/include -fopenmp -c cputim.f

gfortran: warning: Compiler: linker input file unused because linking not
done

gfortran: error: Compiler: linker input file not found: No such file or
directory

gfortran: warning: options=-ffree-form: linker input file unused because
linking not done

gfortran: error: options=-ffree-form: linker input file not found: No such
file or directory

make[1]: *** [Makefile:174: cputim.o] Error 1

make[1]: Leaving directory '/home/victor/WIEN2k23.1/SRC_lapw0'

make: *** [Makefile:125: seq] Error 2

make: *** No rule to make target 'complex'. Stop.




SRC_nn:

rm -f struk.o variable_fields.o nn.o dirlat.o ord2.o reduce_alloc.o bvan.o
angles.o convert_to_cart.o struk.P variable_fields.P nn.P dirlat.P ord2.P
reduce_alloc.P bvan.P angles.P convert_to_cart.P nn.prj dirlat.prj ord2.prj
reduce_alloc.prj bvan.prj angles.prj convert_to_cart.prj struk.prj
variable_fields.prj \

nn.xref *.mod

gfortran Compiler options=-ffree-form -O2 -ftree-vectorize -march=native
-ffree-line-length-none -ffpe-summary=none -fallow-argument-mismatch -c
struk.f

gfortran: warning: Compiler: linker input file unused because linking not
done

gfortran: error: Compiler: linker input file not found: No such file or
directory

gfortran: warning: options=-ffree-form: linker input file unused because
linking not done

gfortran: error: options=-ffree-form: linker input file not found: No such
file or directory

make: *** [Makefile:108: struk.o] Error 1







WIEN2k was installed in /root/WIEN2k23.1/
compiler: gfortran
c compiler: gcc

Parallel compiler, fortran and c : mpifort, mpicc



Best Regards,

Victor Zenou

Wien2k user




‫בתאריך יום ב׳, 12 ביוני 2023 ב-12:09 מאת ‪Victor Zenou‬‏ <‪
zanov at post.bgu.ac.il‬‏>:‬

> WIEN2k 23.2 Install with gfortran:
>
>
> https://github.com/gsabo/WIEN2k-Docs/blob/main/WIEN2k23.2_Ubuntu22.04_Install_with_gfortran.pdf
>
> ‫בתאריך יום ב׳, 12 ביוני 2023 ב-12:03 מאת ‪Peter Blaha‬‏ <‪
> peter.blaha at tuwien.ac.at‬‏>:‬
>
>> You must have made a stupid   copy/paste error  ??
>> Or you mixed comments with actual input options.
>>
>> As I said before, siteconfig should work "out of the box" when all
>> prerequisites are met, with the default options  except the
>> fftw-specific places (and maybe the openblas place).
>>
>> What should that be:
>>
>> gfortran Compiler options=-ffree-form -O2 -ftree-vectorize -march=native
>> -ffree-line-length-none -ffpe-summary=none -fallow-argument-mismatch
>> -DLIBXC -I/home/victor/libxc-6.1.0/include -DFFTW3 -I/homeWIEN2k 23.2
>> Install with gfortran/victor/fftw-3.3.10/include -fopenmp -c cputim.f
>>
>> where does this:    "/homeWIEN2k 23.2 Install with gfortran"   come from ?
>>
>>
>> Am 6/12/23 um 10:51 schrieb Victor Zenou:
>> > gfortran Compiler options=-ffree-form -O2 -ftree-vectorize
>> -march=native
>> > -ffree-line-length-none -ffpe-summary=none -fallow-argument-mismatch
>> > -DLIBXC -I/home/victor/libxc-6.1.0/include -DFFTW3 -I/home*WIEN2k 23.2
>> > Install with gfortran*/victor/fftw-3.3.10/include -fopenmp -c cputim.f
>> >
>>
>> --
>> Peter Blaha, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
>> Phone: +43-1-58801-165300          Email: peter.blaha at tuwien.ac.at
>> WWW: http://www.imc.tuwien.ac      WIEN2k: http://www.wien2k.at
>> _______________________________________________
>> Wien mailing list
>> Wien at zeus.theochem.tuwien.ac.at
>> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
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>> http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
>>
>
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