[Pw_forum] neb.x and -ndiag option
Paolo Giannozzi
giannozz at democritos.it
Mon Apr 16 22:07:13 CEST 2012
On Apr 16, 2012, at 22:05 , Giuseppe Mattioli wrote:
> Is it possible to make the neb.x wrapper able to "pass the -ndiag
> option" to the pw.x engine?
doesn't it work? neb.x -ndiag N ...
P.
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Paolo Giannozzi, Dept of Chemistry&Physics&Environment,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
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