[Pw_forum] problen to run q2r.x code.
Paolo Giannozzi
giannozz at democritos.it
Fri Jan 27 10:24:15 CET 2012
On Thu, 2012-01-26 at 21:51 +0530, bramha pandey wrote:
> file /home/espresso-4.2/phcal/si/dyn.G0 not found
> but i have a file of dyn.G not dyn.G0
the phonon code produces it if you perform a complete
phonon dispersion calculation. If you don't, or if you
are running an old version of the ohonon code, you have
to provide as input variables to q2r.x the information
contained in file dyn.G0
P.
--
Paolo Giannozzi, IOM-Democritos and University of Udine, Italy
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