ATOMIC_SPECIES
Al 27 Al_ONCV_PBE-1.0.upf upf201

NUMERICAL_ORBITAL
Al_gga_8au_100Ry_4s4p1d.orb
 
LATTICE_CONSTANT
10.2  // add lattice constant

LATTICE_VECTORS
0.5 0.5 0.0
0.5 0.0 0.5
0.0 0.5 0.5

ATOMIC_POSITIONS
Direct 

Al	// Element type	
0.0	// magnetism
1	
0.00 0.00 0.00 1 1 1
