[Wien] DOS-Question -Fe

[Stefaan Cottenier]

> 1-I used case 6 to get the plot for Fe-f dos
> the attached file for f-dos is different than the one
> in the note
> is it labeling problem or I did something wrong?

It is a labeling error in the notes.

> 2-Could I know how to trace the way the program
> identify that
> each column belong to each state in the case.qtl i.e.
> how did
> the program tell that this column is number 7 and for
> f-dos

Look at the first lines of case.qtl(up/dn) : there you see a list of labels
for each atom. The position in this list is the number you have to use in
case.int (tot means total, 0 means L=0, etc.)

Stefaan