The scf1 files look absolutely ok.
However, previously you reported: "the calculations freeze";
now you report a:
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Stack trace terminated abnormally.
without any further debugging output. (Did you compile with -traceback ??)
I'd suggest to check compilation
run x kgen and use fewer k-points for debugging
start another scf cycle and ckeck if the problem happens
again.
maybe a problem with an overloaded NFS-filesystem ?
--
P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
Phone: +43-1-58801-15671 FAX: +43-1-58801-15698
Email: blaha at theochem.tuwien.ac.at WWW: http://info.tuwien.ac.at/theochem/
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