[xcrysden] Running XCrySDen

[Gavin Abo]

This was answered over in the WIEN2k mailing list:


http://zeus.theochem.tuwien.ac.at/pipermail/wien/2024-September/034100.html


On 9/2/2024 11:02 AM, delamora wrote:
> ​
> Dear Gavin,
> I try to install what is suggested in the xcrysden page;
> ----------------------------------------------------------
> dnf install tk libglu1-mesa libtogl2 libfftw3-3 libxmu6  imagemagick 
> openbabel libgfortran5
> Última comprobación de caducidad de metadatos hecha hace 0:05:30, el 
> lun 02 sep 2024 09:38:00.
> El paquete tk-1:8.6.13-3.fc40.x86_64 ya está instalado.
> No hay coincidencias para el argumento: libglu1-mesa
> No hay coincidencias para el argumento: libtogl2
> No hay coincidencias para el argumento: libfftw3-3
> No hay coincidencias para el argumento: libxmu6
> No hay coincidencias para el argumento: imagemagick
>   * Tal vez quiso decir: ImageMagick
> No hay coincidencias para el argumento: libgfortran5
> Error: No se pudo encontrar ningún resultado: libglu1-mesa libtogl2 
> libfftw3-3 libxmu6 imagemagick libgfortran5
> -----------------------------------
> There were no results for
> libglu1-mesa libtogl2 libfftw3-3 libxmu6 imagemagick libgfortran5
> but
> ImageMagick
> is already installed.
>
> Cheers
>
> Pablo
> ------------------------------------------------------------------------
> *
> *
> Estimado Gavin,
>
> Running xcrysden, now it opens, but it gives this error;
>
> ./ftnunit: error while loading shared libraries: libgfortran.so.5: 
> cannot open shared object file: No such file or directory
>
> I have intel fortran in
>
> pablo at fedora:/home/Programas/xcrysden-1.6.2-bin-shared$ locate libgfortran
> /opt/intel/oneapi/intelpython/python3.9/pkgs/_openmp_mutex-4.5-1_gnu/info/recipe/parent/install-libgfortran.sh
> /opt/intel/oneapi/intelpython/python3.9/pkgs/libgcc-ng-9.3.0-h5101ec6_17/info/recipe/parent/install-libgfortran.sh
> /opt/intel/oneapi/intelpython/python3.9/pkgs/libgomp-9.3.0-h5101ec6_17/info/recipe/parent/install-libgfortran.sh
> /opt/intel/oneapi/intelpython/python3.9/pkgs/libstdcxx-ng-9.3.0-hd4cf53a_17/info/recipe/parent/install-libgfortran.sh
> /var/lib/flatpak/runtime/org.fedoraproject.KDE6Platform/x86_64/f40/286405d778e073e4e01d75c42074307b13cfec2e00913baf6d552d8e7c584670/files/lib64/libgfortran.so.5
> /var/lib/flatpak/runtime/org.fedoraproject.KDE6Platform/x86_64/f40/286405d778e073e4e01d75c42074307b13cfec2e00913baf6d552d8e7c584670/files/lib64/libgfortran.so.5.0.0
>
> how to link intel fortran with xcrysden
>
> Pablo
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