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=18.912988372844374 stress="-2.1765259269272605 -0.41529720474398374 -0.18736582523622114 -0.41529720474398374 -2.5610321399939613 0.2333807234211759 -0.18736582523622114 0.2333807234211759 -1.9713474785563065" free_energy=18.912988372844374 pbc="F T F" Ni 0.04852473 0.01848935 0.13661615 -28.04492559 -2.56800668 -23.54883704 Ni 1.40480033 1.28303047 0.11041876 18.22099962 6.55010556 -19.59398107 Ni 1.26735611 -0.16466555 1.24148635 28.51597260 2.09861552 25.40713008 Ni 0.08611608 1.53369179 1.52598936 -18.69204663 -6.08071440 17.73568802