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Posted: **Fri Oct 18, 2013 8:34 am**

How can I use two sets of (U,J) for the same atom with different orbital?

For example, U_f=5eV and U_d=3eV for La atom is possible?

Posted: **Fri Oct 18, 2013 11:26 am**

Normally only one type of orbital contains nonbonding electrons. The U correction is programmed only for one type of orbital at the same atom.

Different U value at same atrom