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=31.583688068524925 stress="-2.9648019600454854 -0.02496742803625715 0.06080558269403902 -0.02496742803625715 -2.542755894258524 -0.12814318902332275 0.06080558269403902 -0.12814318902332275 -3.4906745701449324" free_energy=31.583688068524925 pbc="T F T" Al 0.03848316 0.19178619 0.17895518 10.97777365 -25.12192527 -10.88277181 Al 1.79140871 1.61455359 0.03253581 -15.43587098 24.62649848 -2.94911623 Al 1.64904689 0.10609294 1.46603997 -14.47906816 -27.19651414 6.55817738 Al -0.19401975 1.32157598 1.51361598 18.93716549 27.69194093 7.27371066