Dear all, while running a -so calculation I hit a segmentation fault in lapwso (see below) with the latest version Wien2k21.1 that does NOT appear in 19.2. (appeared for two different systems in fresh directories)
Did someone experience the same, or did I miss a report and may be not up to date? I used all settings the same (mostly default values), and the same compilers and options (Intel OneAPI 2021 2.0 and Parallel Studio XE 2017.4.056) for both versions, 21.1 and 19.2 forrtl: severe (174): SIGSEGV, segmentation fault occurred Image PC Routine Line Source lapwso 000000000046CE0A Unknown Unknown Unknown libpthread-2.22.s 00002AFBCC6DAB10 Unknown Unknown Unknown libiomp5.so 00002AFBCCF2C8E8 Unknown Unknown Unknown lapwso 000000000049F7A6 Unknown Unknown Unknown lapwso 0000000000421E9E hmsec_ 926 hmsec.F line 926 is; deallocate(meigve) indeed, if this is the correct line at all. indeed in 21.2 (I have seen that hmsec.F is different in 19.2) Thanks for any suggestions that help Gerhard DEEP THOUGHT in D. Adams; Hitchhikers Guide to the Galaxy: "I think the problem, to be quite honest with you, is that you have never actually known what the question is." ==================================== Dr. Gerhard H. Fecher Institut of Physics Johannes Gutenberg - University 55099 Mainz _______________________________________________ Wien mailing list Wien@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