[QE-users] dynamical matrix after restart

[Lorenzo Paulatto]

Please see
PHonon/examples/GRID_example
and
PHonon/examples/GRID_recover_example
regards
LP

--
Lorenzo Paulatto - Paris
On Jan 26 2021, at 7:48 am, Бунтов Евгений Александрович <e.a.buntov at urfu.ru> wrote:
>
> Dear all,
>
>
> I try to calculate Raman frequencies for a 64-atom slab with ph.x in QE v.6.4.1.
> I had to interrupt the calculation at certain representation, then I calculated the rest using start_irr/last_irr.
> At the end the fildyn file is empty, so I can’t use dynmat.x.
> Can I create a dynamical matrix from the existing xml files in phsave directory without performing all the calculations once again?
>
> Regards,
> Evgeny
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