Dear Peter, Thank you.
I might have downloaded it from a different website but I did compile it. Just now I downloaded it from the link you had shared and tried to compile, when I gave the command autoreconf -i --force, I get this error. autoreconf: error: 'configure.ac' is required Kindly guide what should I do. Thank you. With warm regards, Pranjal -----Original Message----- From: Wien <[email protected]> On Behalf Of Peter Blaha Sent: Monday, March 25, 2024 3:59 PM To: [email protected] Subject: Re: [Wien] Compilation error of Libxc during installation of WIEN2K 23.2 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 > [email protected] > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: > http://www.mail-archive.com/[email protected]/index.html -- -------------------------------------------------------------------------- Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna Phone: +43-1-58801-165300 Email: [email protected] WIEN2k: http://www.wien2k.at WWW: http://www.imc.tuwien.ac.at ------------------------------------------------------------------------- _______________________________________________ Wien mailing list [email protected] http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/[email protected]/index.html 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 [email protected] http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien SEARCH the MAILING-LIST at: http://www.mail-archive.com/[email protected]/index.html
