1
Lattice="1.804222 -1.804222 0.0 -1.804222 0.0 -1.804222 1.804222 1.804222 0.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-3.6761618741472195 stress="-0.019248790112740468 -1.8834349172195644e-17 0.0 -1.8834349172195644e-17 -0.019248790112740468 3.6293124130687976e-19 0.0 3.6293124130687976e-19 -0.019248790112740465" dipole="-2.6562019970555834e-16 4.818096236192701e-16 1.3398211543035175e-16" pbc="T T T"
Cu       0.00000000       0.00000000       0.00000000      -0.00000000       0.00000000       0.00000000