[Wien] band structure of supercell

2015-11-25 Thread mitra narimani 
Hi dear Belaha
 I carried out anything that you and your coworkers said but I didnt reach
to any conclusion aboat my problem, I work with wien2k version 13.1.  Is
maybe this problem from this version of wien2k? I used number 2 for line
switch, the problem of my band structure is that in line
0 1 0.2 # jatom, jtype, size of heavier plotting
when I changed the jatom (0 to 1,2,3,4,...) or jtype (1 to 2,3,4,...) or
size of heavior plotting (0.2 to 2,3,4,5,...), my band structure doesnt
have any change and remain same as defult and s, p, d, f characters not be
shown, however I run x lapw2 -p -c -so -band -qtl.My case has 96 atoms with
impurity doped it by 3%. my k-point is 350, RmtKmax=8.5 and Gmax=12.5.
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[Wien] band structure of supercell

2015-11-23 Thread mitra narimani 
I used number 2 for line switch, the problem of my band structure is that
in line
0 1 0.2 # jatom, jtype, size of heavier plotting
when I change the jatom or jtype or size of heavior plotting, my band
structure doesnt have any change and remain same as defult and s, p, d, f
characters not be shown, however I run x lapw2 -p -c -so -band -qtl.My case
has 96 atoms with impurity doped it by 3%. Is the version 14.2 able to
solve this problem which you suggest me before?
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