[Wien] problem with eece
Kevin Jorissen
kevinjorissenpdx at gmail.com
Fri Aug 29 04:04:01 CEST 2014
mistake in your input?
On Thu, Aug 28, 2014 at 5:28 PM, Hemza Kouarta <hemzakouarta.phy at gmail.com>
wrote:
> Hi,
>
> i use HF function on the 3d metal (Fe) intercalated in NbSe2 ,my
> calculation is fine and converged,but when i do :
>
> " x lapw2 -up -so -eece -qtl " to calculate dos ,they give me this error
> :
>
>
> WARNING: EF not accurate, new emin,emax,NE-min,NE-max
> -2.96097358895238
> -2.96097358242661 87.9999969931765 88.0000074270098
> LAPW2 END
> 106.7u 4.6s 1:51.69 99.6% 0+0k 56+69824io 0pf+0w
>
>
> And when i draw the dos there is no EF in my dos.
>
> Any suggestions will help.
>
> thank-you.
>
>
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