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=315.70450418449644 stress="-39.291088492936694 -3.699803373563559 15.907969317934791 -3.699803373563559 -22.3514508918635 7.137075338688818 15.907969317934791 7.137075338688818 -70.03632947305485" free_energy=315.70450418449644 pbc="T T T" Cu 0.25551247 2.85444624 2.99188881 -479.96648283 112.99400547 424.52509296 Cu 1.56482696 1.46656091 0.01821382 -114.11240085 -36.10573051 -125.71268203 Ta 1.20575425 2.92594471 1.65586213 505.54729516 54.13448651 -619.29669902 Ta 2.90395547 1.58070518 1.23049600 88.53158852 -131.02276147 320.48428810