[Pw_forum] Where to find old format pseudopotential files?
José Rui Faustino de Sousa
jrfsousa at teor.fis.uc.pt
Tue Jul 25 18:59:17 CEST 2006
On Mon, 2006-07-24 at 16:32 +0200, Paolo Giannozzi wrote:
> On Thursday 13 July 2006 12:38, José Rui Faustino de Sousa wrote:
> it looks reasonably correct.
>
Thank you very much for taking the time to look at that.
> For the core correction:
> rho_core(r) = (a_nlcc + b_nlcc*r^2) exp ( -alpha_nlcc*r^2)
>
Do you know any citation to that formula? And, by the way, for the
scheme to construct the radial logarithmic grid?
Thank you very much.
Best regards
José Rui
P.S.- Your notes on pseudopotential generation have been very handy!
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