[Pw_forum] Generate pseudopotential for Sb

[Vo, Trinh (388C)]

Here are the commands that I used (I don't know if I used the wrong files):

plot [0:6]   "ld1ps.wfc" u 1:3 w l lw 2
replot  "ld1ps.wfc" u 1:4 w l lw 2
replot  "ld1ps.wfc" u 1:8 w l lw 2
replot  "ld1ps.wfc" u 1:9 w l lw 2

Or 
replot  "ld1.wfc" u 1:(-$7) w l lw 2
replot  "ld1.wfc" u 1:(-$8) w l lw 2

Thank you,

Trinh


On 3/3/10 12:22 PM, "Lorenzo Paulatto" <paulatto at sissa.it> wrote:

> Replying to message "Re: [Pw_forum] Generate pseudopotential for Sb" from
> Vo, Trinh (388C) (03/03/10):
>> I did not see they coincide at r>rcut (rcut=0.8 au) for the 4d wfc.
>> Attached is my plot. Did you have different plot.  I use QE 4.1.2.
> 
> Are you sure you ploted the right couple? Maybe you are comparing the US
> wavefunction at an energy/j with the AE at another energy/j. To be sure, I
> would have to check the command you have used to generate the plot, more
> than the plot itself.
> 
> cheers
>