include '/gpfs0/physp2/dellnw3/PO4/pwpaw/AtomData/P-LDA-V-S/P.atomicdata' include '/gpfs0/physp2/dellnw3/PO4/pwpaw/AtomData/O-LDA-V-S/O.atomicdata' AtomType_Occupancy P Orbitals_Size 4 Valence_Orbitals 1 2 3 4 Valence_occupancy 2 2 6 3 End AtomType_Occupancy O Orbitals_Size 2 Valence_Orbitals 1 3 Valence_occupancy 2 4 End