Dear users:
I am doing an optimization with -5 -2 0 2 5 volume change. Now I have
finished -5 -2 calculation and the 0 calculation have run 5 cycles, but the
electric power will be cut in a few hours so I have to stop it by .stop. My
question is can we continue with the scf from where it stoped(the fifth
iteration of 0 volume change calculation) later or do we have to remove the
files case.broyd and rerun the optimization of 0 2 5 volume change from
beginning again.
_______________________________________________
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
