[Pw_forum] wf_collect and postprocessing
Paolo Giannozzi
p.giannozzi at gmail.com
Tue Jul 28 12:53:18 CEST 2015
On Tue, Jul 28, 2015 at 12:43 PM, Manjusha Chugh <chughmanjusha at gmail.com>
wrote:
I have figured out that pp.x can be run on different number of processors
> than what have been used for scf and nscf calculations, but projwfc.x
> cannot.
>
it can. I don't know why you have problems but projwfc.x can also read
wavefucntions in collected form. Please verify that your outdir is clean
and doesn't contain leftover files like *.wfcN or *wfcNN files
Paolo
--
Paolo Giannozzi, Dept. Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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