Dear Prof Blaha I tried to run TiC in the wien2k 12 in my hp proliant ml110 using centos 6. After reading the mail posted by Gavin Abo and your reply I put the three subroutines? (eramps.f, fft_modules.F fftpack_helpers.f) and recompiled. I got the following error: ?LAPW0 END ?LAPW1 END ?LAPW2 END ?CORE? END ?MIXER END ec cc and fc_conv 0 0 1 in cycle 2??? ETEST: 0?? CTEST: 0 forrtl: severe (174): SIGSEGV, segmentation fault occurred Image????????????? PC??????????????? Routine??????????? Line??????? Source????????? ??? lapw0????????????? 00000000004268FC? energy_?????????????????? 175? energy.F lapw0????????????? 000000000045BB83? MAIN__?????????????????? 1971? lapw0.F lapw0????????????? 00000000004039FC? Unknown?????????????? Unknown? Unknown libc.so.6????????? 00002B8EA77CEC5D? Unknown?????????????? Unknown? Unknown lapw0????????????? 00000000004038F9? Unknown?????????????? Unknown? Unknown ? >?? stop error In the latest mails, options of linking for parallel mode are discussed. Is there any options needed for non parallel mode.
Yours sincerely Jameson Maibam -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120726/a4d99f91/attachment.htm>
