18.6.2 Defining the core orbitals (CORE)

CORE, $c_1$, $c_2 \ldots$

The first $c_i$ orbitals in each symmetry are treated as core orbitals and not localized. Thus, orbitals $c_i+1$ to $o_i$ are localized in symmetry $i$.



molpro@molpro.net 2018-11-17