[Wien] minor error(?) report : confusing behavior in QTL? (symmetrize)

[Kim Kyoo]

Dear W2k users,

This is slightly confusing:
in the case.inq file, the symmetrize tags do not work separately for each
atom.
it just takes the last value.
e.g. In the following case, symmetrize is on.


-9.0   3.0           Emin  Emax
   2                 number of atoms
   1   2  0  0       iatom,qsplit,symmetrize,locrot
1   2                nL, l-values
   2  -2  1  0       iatom,qsplit,symmetrize,locrot
2   0  1             nL, l-values

Best,

Kyoo

Kyoo Kim
dept of Physics,
POSTECH, Pohang
Korea
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