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

[Antonio]

Dear Lorenzo.

Thank you for your contribution.

2011/8/29 Lorenzo Paulatto <Lorenzo.Paulatto at impmc.upmc.fr>:
> 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/
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-- 
Doutorando Antônio M. Da Silva Jr.
NEQC: Nucleo de Estudos em Quimica Computacional
Departamento de Quimica - ICE
Universidade Federal de Juiz de Fora
Campus Universitario S/N 36.036-330
Juiz de Fora - MG - Brasil
http://lattes.cnpq.br/0895213089855328