[Pw_forum] Phonon: "data-file.#iq.#irr.xml" files

Lorenzo Paulatto Lorenzo.Paulatto at impmc.upmc.fr
Mon Aug 29 15:46:35 CEST 2011

On Mon, 29 Aug 2011 15:07:21 +0200, Antonio <antonio.msj1 at gmail.com> wrote:
> In phonon calculations are generated some "data-file.#iq.#irr.xml"
> files (*.phsave directory). In this files there are two columns. what
> information are contained there?

Dear Antonio,
those are internal files, which are not supposed to be read by the code  
users... anyway, the columns are the real and imaginary part of the  
element of line #irr if the dynamical matrix at point #iq

best regards

Lorenzo Paulatto IdR @ IMPMC/CNRS & Université Paris 6
phone: +33 (0)1 44275 084 / skype: paulatz
www:   http://www-int.impmc.upmc.fr/~paulatto/
mail:  23-24/4é16 Boîte courrier 115, 4 place Jussieu 75252 Paris Cédex 05

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