[Pw_forum] Aluminium EPC at X
Nicola Marzari
marzari at MIT.EDU
Sun Mar 25 20:08:57 CEST 2007
Amit Kumar wrote:
>
>
> Respected Users,
>
> I'm very much confused with the results of the electron-phonon
> coupling of Aluminium
> at X-point. You can see a large discrepancy in the results of
> Example No. 7.
Hi Amit,
the example is not meant to represent a fully converged calculation -
it would take too long to run. It's really meant to give you a
framework to look for convergence yourself. This can be extremely
expensive, for electron-phonon coupling (see e.g. a discussion in the
recent Giustino PRL).
nicola
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