+----------------------------+ | Real-space lattice vectors | +----------------------------+ vector a1 : 7.260500000 0.000000000 0.000000000 vector a2 : 0.000000000 7.260500000 0.000000000 vector a3 : 0.000000000 0.000000000 7.260500000 Stored column-wise as a matrix : 7.260500000 0.000000000 0.000000000 0.000000000 7.260500000 0.000000000 0.000000000 0.000000000 7.260500000 Inverse of matrix : 0.1377315612 0.000000000 0.000000000 0.000000000 0.1377315612 0.000000000 0.000000000 0.000000000 0.1377315612 Unit cell volume : 382.7362428 +----------------------------------+ | Reciprocal-space lattice vectors | +----------------------------------+ vector b1 : 0.8653929216 0.000000000 0.000000000 vector b2 : 0.000000000 0.8653929216 0.000000000 vector b3 : 0.000000000 0.000000000 0.8653929216 Stored column-wise as a matrix : 0.8653929216 0.000000000 0.000000000 0.000000000 0.8653929216 0.000000000 0.000000000 0.000000000 0.8653929216 Inverse of matrix : 1.155544464 0.000000000 0.000000000 0.000000000 1.155544464 0.000000000 0.000000000 0.000000000 1.155544464 Brillouin zone volume : 0.6480970070