The problem might be with the FFTW-LIBS.  In the steps at [1], it looks like it set to "lib", but it is set to "lib64" in your case.

Check if libfftw3_mpi.a exists in lib or lib64.

For example, if the file exists in lib:

username@computername:~$ ls /home/username/fftw3/lib
cmake  libfftw3.a  libfftw3.la  libfftw3_mpi.a  libfftw3_mpi.la pkgconfig

Then, adjust your settings accordingly:

username@computername:~$ cd $WIENROOT
username@computername:~/WIEN2k$ ./siteconfig
...
  Selection: O
...
  F   FFTW options:            -DFFTW3 -I/home/username/fftw3/include
      FFTW-LIBS:               -L/home/username/fftw3/lib64 -lfftw3
      FFTW-PLIBS:              NOT FOUND!
...
Selection: F
...
Selection:L
Enter the target achitecture of your FFTW library (e.g. lib64)!: lib
...
   FFTW_OPT:             -DFFTW3 -I/home/username/fftw3/include
   FFTW_LIBS:            -L/home/username/fftw3/lib -lfftw3
   FFTW-PLIBS:           -lfftw3_mpi
...

[1] https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg18664.html

On 7/3/2019 3:27 AM, Riyajul Islam wrote:
Hellow wien2k users,
I am facing a problem in compiling FFTW in sitecofiguration. I have followed all the steps as in "https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg18664.html";. But could nopt acces the "/home/username/fftw3/mpi/.libs/libfftw3_mpi.a" as in in mailing list.
the current settings for FFTW is
F   FFTW options:            -DFFTW3 -I/home/edison1/fftw3/include
      FFTW-LIBS:               -L/home/edison1/fftw3/lib64 -lfftw3
      FFTW-PLIBS:              NOT FOUND!

How can I solve this issue?

Regards,
Riyajul Islam

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