[Pw_forum] electron-phonon coupling and pseudopotential choice

Oleg Sergeev seoman at yandex.ru
Wed Jun 30 17:10:48 CEST 2010


stefano, thank you very much for the quick answer. i think my fault was that i didn't recalculate the lattice parameter for each new PP. i'll check it.

Oleg Sergeev,
JIHT RAS, Moscow.

> example07 is meant to show the procedure to compute el-ph coupling NOT 
> to represent a converged calculation of it.
> Have you checked convergence of your calculation w.r.t . cutoff, 
> k-points and so on.
> Have you calculate consistently the lattice parameter of your system ?
> stefano



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