[Wien] Compilation error of Libxc during installation of WIEN2K 23.2
Peter Blaha
peter.blaha at tuwien.ac.at
Mon Mar 25 15:58:44 CET 2024
The libxc site has been moved recently to:
https://libxc.gitlab.io/
After download, you have to compile it. Did you do this ?
Then you need to configure wien2k in siteconfig properly for using libxc.
Am 25.03.2024 um 15:29 schrieb Pranjal Nandi:
> Dear All,
>
> Hello.
>
> While compiling the 23.2 version, the link mentioned in the pdf (which
> contains the codes used for the compilation) to install libxc was NOT
> working
> (http://www.tddft.org/programs/libxc/down.php?file=6.2.2/libxc-6.2.2.tar.gz <http://www.tddft.org/programs/libxc/down.php?file=6.2.2/libxc-6.2.2.tar.gz>).
>
> So I tried to download it from other websites and did the compilation.
> The only errors I saw are as the following.
>
> Fatal Error: Cannot open module file ‘xc_f03_lib_m.mod’ for reading at
> (1): No such file or directory
>
> compilation terminated.
>
> make[1]: *** [Makefile:176: libxc_mod.o] Error 1
>
> make[1]: Leaving directory '/home/pranjal2/WIEN2K/SRC_lapw0'
>
> make: *** [Makefile:129: para] Error 2
>
> It would be helpful if you could please guide me with the correct link
> to the libxc (I think it is because of downloading the libxc from other
> websites and not TDDFT).
>
> I also searched the forum regarding the same but I got comments about a
> very old version. Hence, I decided to ask the community for your
> assistance.
>
> Looking forward to your guidance.
>
> Thank you.
>
> With warm regards,
>
> Pranjal
>
>
>
> Aquest missatge, i els fitxers adjunts que hi pugui haver, pot contenir
> informació confidencial o protegida legalment i s’adreça exclusivament a
> la persona o entitat destinatària. Si no consteu com a destinatari final
> o no teniu l’encàrrec de rebre’l, no esteu autoritzat a llegir-lo,
> retenir-lo, modificar-lo, distribuir-lo, copiar-lo ni a revelar-ne el
> contingut. Si l’heu rebut per error, informeu-ne el remitent i elimineu
> del sistema tant el missatge com els fitxers adjunts que hi pugui haver.
>
> Este mensaje, y los ficheros adjuntos que pueda incluir, puede contener
> información confidencial o legalmente protegida y está exclusivamente
> dirigido a la persona o entidad destinataria. Si usted no consta como
> destinatario final ni es la persona encargada de recibirlo, no está
> autorizado a leerlo, retenerlo, modificarlo, distribuirlo o copiarlo, ni
> a revelar su contenido. Si lo ha recibido por error, informe de ello al
> remitente y elimine del sistema tanto el mensaje como los ficheros
> adjuntos que pueda contener.
>
> This email message and any attachments it carries may contain
> confidential or legally protected material and are intended solely for
> the individual or organization to whom they are addressed. If you are
> not the intended recipient of this message or the person responsible for
> processing it, then you are not authorized to read, save, modify, send,
> copy or disclose any part of it. If you have received the message by
> mistake, please inform the sender of this and eliminate the message and
> any attachments it carries from your account.
>
>
> _______________________________________________
> Wien mailing list
> Wien at zeus.theochem.tuwien.ac.at
> http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien
> SEARCH the MAILING-LIST at: http://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/index.html
--
--------------------------------------------------------------------------
Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-165300
Email: peter.blaha at tuwien.ac.at WIEN2k: http://www.wien2k.at
WWW: http://www.imc.tuwien.ac.at
-------------------------------------------------------------------------
More information about the Wien
mailing list