[Wien] Bandstructure with band character
yulihua-wuhan
yulihua-wuhan at sohu.com
Thu Jul 10 17:03:05 CEST 2003
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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