No subject
Wed Jul 6 14:13:09 CEST 2005
once lapw1 and lapw2 (with qtl are done), you need just to re-run x spaghetti
when you change things in case.insp
Good luck
A. Kara
>
> Dear Wien users:
>
> When I plot the Bandstructure with band character, I have a trouble: gnuplot only generate the general band plot (only some lines), without the l-decomposed project. I use the Wien2k_02 downloaded in 2002, December.
> My process is :
> 1. Insert k-points in case.in1c, change 4-->5
> 2. x lapw1 -band -c
> 3. x lapw2 -qtl -band -c
> 4. Edit case.insp
> jatom=2, jtype=2 and jsize=0.2 ( for atom2, s electrons)
> 5. x spaghetti
>
> I remember, in the Wien2k_01, must edit case.in2c: change FERMI method from TETRA to ROOT, then run lapw2,
> I do this, but the result is same.
> What is wrong in this case?
>
> Thanks a lot
> Lihua Yu
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