include '/gpfs0/physp2/dellnw3/Li2O/pwpaw/AtomData/Li-GGA-V-S/Li.atomicdata' include '/gpfs0/physp2/dellnw3/Li2O/pwpaw/AtomData/O-GGA-V-S/O.atomicdata' AtomType_Occupancy Li Orbitals_Size 2 Valence_Orbitals 1 2 Valence_occupancy 2 1 End AtomType_Occupancy O Orbitals_Size 2 Valence_Orbitals 1 3 Valence_Occupancy 2 4 End