[Pw_forum] Strange pp.x output after vc-relax (v3.1)
Paolo Giannozzi
giannozz at nest.sns.it
Tue Jun 27 17:13:57 CEST 2006
On Tuesday 27 June 2006 12:34, Steven Kirk wrote:
> The problem is that the output cell parameters (at least) in the output
> .XSF file are the ORIGINAL cell parameters, not the RELAXED cell
> parameters.
are you really sure you are reading the final data files and not
something else?
Paolo
--
Paolo Giannozzi e-mail: giannozz at nest.sns.it
Scuola Normale Superiore Phone: +39/050-509876, Fax:-563513
Piazza dei Cavalieri 7 I-56126 Pisa, Italy
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