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=11.779187702935152 stress="-2.7502472861492535 -0.9210940864165962 -0.10108150875881705 -0.9210940864165962 -2.466734690686204 0.2859287951817817 -0.10108150875881705 0.2859287951817817 -1.7969162224272188" free_energy=11.779187702935152 pbc="F T F" Cu 0.04852473 0.35348325 0.13661615 -42.21064461 -18.08351896 -20.62620355 Cu 1.40480033 1.15010476 0.11041876 34.98703385 24.60800562 -18.51593525 Cu 1.26735611 2.83533445 1.24148635 22.46205352 -6.99301666 22.32442667 Cu 0.08611608 1.53369179 1.52598936 -15.23844276 0.46853000 16.81771213