4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1.1179117548677249 stress="-2.4504717042228616 -0.5569510773215702 0.260918505879601 -0.5569510773215702 -2.0000776169192918 -0.5879824251260511 0.260918505879601 -0.5879824251260511 -2.4855928485843157" free_energy=1.1179117548677249 pbc="T F T" Cu 0.03848316 0.19178619 0.17895518 15.87954803 -17.29222531 -23.11805921 Cu 1.79140871 1.61455359 0.03253581 -13.61569659 10.48611954 -4.33479450 Cu 1.64904689 0.10609294 1.31802703 -30.41369021 -25.82785338 7.38227011 Cu -0.19401975 1.32157598 1.51361598 28.14983877 32.63395915 20.07058360