GGA/LDA+U method
Posted: Fri Jul 23, 2010 2:59 am
hi,
Is the GGA(LDA)+U method applicable only to systems with partially filled d or f electrons? What about the systems with fully filled d or f orbitals? Could someone please explain.
Thanks.
Is the GGA(LDA)+U method applicable only to systems with partially filled d or f electrons? What about the systems with fully filled d or f orbitals? Could someone please explain.
Thanks.