[Wien] Problem in wien2k17 installation on remote server

[Gavin Abo]

The compile.msg tells you exactly what is wrong:

error: /opt/libopenblas: No such file or directory
error: /opt/liblapack: No such file or directory

Using those BLAS and lapack, I don't know.  Those might be operating 
systems package ones.  Maybe they are not installed [ 
https://askubuntu.com/questions/623578/installing-blas-and-lapack-packages 
]:

sudo apt-get install libblas-dev liblapack-dev

Or maybe the library filenames are different.  Maybe they have to be 
changed to:

  R   R_LIBS (LAPACK+BLAS):    /opt/libopenblas.a /opt/liblapack.a -lpthread

However, as I already mentioned, I use:

  R   R_LIBS (LAPACK+BLAS):    -L/home/ubuntu/OpenBLAS-0.2.20 -lopenblas 
-llapack_lapw -lpthread

Where I installed OpenBLAS with [ 
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg17175.html 
]:

ubuntu at ubuntu:~$ cd ~
ubuntu at ubuntu:~$ wget 
http://github.com/xianyi/OpenBLAS/archive/v0.2.20.tar.gz
...
ubuntu at ubuntu:~$ tar zxvf v0.2.20.tar.gz
...
ubuntu at ubuntu:~$ cd OpenBLAS-0.2.20/
ubuntu at ubuntu:~/OpenBLAS-0.2.20$ make FC=gfortran

On 9/1/2018 11:23 AM, Indranil mal wrote:
> Thank you for your reply. As I am new in LINUX operating system I 
> could not follow you initially sorry for that. However I am using
>
> Ubuntu 18.04.1 LTS
> Memory 31.3 GiB
> processor Intel® Core™ i7-7700 CPU @ 3.60GHz × 8
> Graphics Intel® HD Graphics 630 (Kaby Lake GT2)
> GNOME 3.28.2
> OS type 64-bit
> Disk 200.6 GB
> Please inform me what are the information you need to analyze the 
> errors. I will try to provide you.
>
> this time I have used all the recommended options for compiler and linker
>
>
> ***********************************************************************
>  *                 Specify compiler and linker options                 *
>  ***********************************************************************
>
>
>  Recommended options for system linuxgfortran are:
>       Compiler options:        -ffree-form -O2 -ffree-line-length-none
>       Linker Flags:            $(FOPT) -L../SRC_lib
>       Preprocessor flags:      '-DParallel'
>       R_LIB (LAPACK+BLAS):     /opt/libopenblas /opt/liblapack -lpthread
>
>  Current settings:
>   O   Compiler options:        -ffree-form -O2 -ffree-line-length-none
>   L   Linker Flags:            $(FOPT)
>   P   Preprocessor flags       '-DParallel'
>   R   R_LIBS (LAPACK+BLAS):    /opt/libopenblas /opt/liblapack -lpthread
>   X   LIBX options:            -DLIBXC -I/opt/etsf/include
>       LIBXC-LIBS:              -L/opt/etsf/lib/ -lxcf03 -lxc
>
> I have got the attached error while compiling.
>
> Thanking you
> Indranil