+----------------------------+ | Real-space lattice vectors | +----------------------------+ vector a1 : 6.750100000 0.000000000 0.000000000 vector a2 : 0.000000000 6.750100000 0.000000000 vector a3 : 0.000000000 0.000000000 6.750100000 Stored column-wise as a matrix : 6.750100000 0.000000000 0.000000000 0.000000000 6.750100000 0.000000000 0.000000000 0.000000000 6.750100000 Inverse of matrix : 0.1481459534 0.000000000 0.000000000 0.000000000 0.1481459534 0.000000000 0.000000000 0.000000000 0.1481459534 Unit cell volume : 307.5605440 +----------------------------------+ | Reciprocal-space lattice vectors | +----------------------------------+ vector b1 : 0.9308284777 0.000000000 0.000000000 vector b2 : 0.000000000 0.9308284777 0.000000000 vector b3 : 0.000000000 0.000000000 0.9308284777 Stored column-wise as a matrix : 0.9308284777 0.000000000 0.000000000 0.000000000 0.9308284777 0.000000000 0.000000000 0.000000000 0.9308284777 Inverse of matrix : 1.074311781 0.000000000 0.000000000 0.000000000 1.074311781 0.000000000 0.000000000 0.000000000 1.074311781 Brillouin zone volume : 0.8065085666