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=16.277543188314393 stress="-2.151911614492315 -0.5970372883434488 -0.15622017252678871 -0.5970372883434488 -2.324719747110525 0.5649771377917278 -0.15622017252678871 0.5649771377917278 -2.072040588585599" free_energy=16.277543188314393 pbc="T T F" Cu -0.13449789 -0.21197381 0.22277084 17.06352512 22.79476880 -20.92908826 Cu 1.68584377 1.68362810 0.19581920 -21.65816263 -11.69158030 -20.51106146 Cu 1.64685009 0.42259636 1.67626233 -11.93192553 -8.01454672 15.15974033 Cu -0.14597521 1.70996341 1.49207130 16.52656304 -3.08864178 26.28040939