[Pw_forum] error in restarting pw.x
Federico Iori
federico.iori at u-psud.fr
Sat Apr 30 13:25:34 CEST 2016
Hi all.
I did a 'scf' run with pw.x (QE_5.4.0) and now I tryed to restart it to relax the coordinates ('relax' run).
I am using
restart_mode='restart'
wf_collect=.true. (since I changed the number of proc from one run to the other)
and do not specified startingpot and startingwfc
I obtained always an error:
"Error in routine read_wavefunctions" (1)
wavefunctions unit (iunwfc) is not opened
Now I tried specifing starginwfc='atomic+random' (that is the default)
and the code is running..
I do not change neither the k-points neither the cutoff values...
Myabe is something known, but someone has an idea why is this happening?
Thanks
Federico
Federico IORI
Marie Curie Fellow
Laboratoire de Physique des Solides
Bâtiment 510 - Rue André Rivière
91400 Orsay
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