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=126.46269460276898 stress="-6.733606719718828 1.5367688036269676 -0.6624439532565366 1.5367688036269676 -12.216981527263833 0.9082858827527123 -0.6624439532565366 0.9082858827527123 -15.29571151964861" free_energy=126.46269460276898 pbc="F T F" C 0.07255377 0.14066906 0.01258782 -65.09971863 -8.90223492 -135.43768737 C 1.66911338 1.30454100 0.12365747 37.05492275 44.34651553 -158.62498391 Cu 1.45588739 2.95297513 1.34681875 87.57673493 -80.35917564 197.75809285 Cu 0.04737131 1.29056869 1.74404962 -59.53193905 44.91489503 96.30457842