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=0.8710551754645884 stress="-1.24677689356887 -0.34396948794466575 0.4114760868166644 -0.34396948794466575 -2.2384522637151534 0.4041367071563477 0.4114760868166644 0.4041367071563477 -2.0317928493974007" free_energy=0.8710551754645884 pbc="F T T" Ni 0.22094491 0.23171545 0.18190327 -12.14546683 -0.37629955 -4.85452978 Ni 1.32183498 1.71219253 2.92485375 11.70668139 -15.13650472 11.13736873 Ni 1.62990665 2.78220450 1.78278197 13.29558607 18.12400431 -15.54328826 Ni 0.06210000 1.70397289 1.32702941 -12.85680062 -2.61120003 9.26044931