gsphere input (gsphere.inp)
gsphere
code input format (gsphere.inp
)
25.917768986 0.000000000 0.000000000 # a1x a1y a1z [= lattice vectors (bohr)]
0.000000000 14.496126116 0.000000000 # a2x a2y a2z
0.000000000 0.000000000 28.284379996 # a3x a3y a3z
240.0 # energy cutoff (Ry)
0 0 0 # FFT_grid_x FFT_grid_y FFT_grid_z (set to zero to determine automatically)
false # whether to sort G-vectors by kinetic energy (true) or leave unsorted (false)
0.0 0.0 0.0 # kx ky kz (k-point at which to generate G-vectors, crystal coordinates)