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=10.851513656825945 stress="-1.6927652910873738 0.08817547082359811 -0.032830423900033816 0.08817547082359811 -0.7445596145278902 0.0009360244523356562 -0.032830423900033816 0.0009360244523356562 -1.204842744903996" free_energy=10.851513656825945 pbc="F T F" Ta 0.26235339 2.77372337 0.21005355 -15.94475266 4.86060133 -14.41808064 Ta 1.71211731 1.49344861 0.29594673 17.00800544 -5.10404515 -15.57278893 Ta 1.65710459 2.71094383 1.35687199 14.84919521 3.54838044 17.01902898 Ta 0.24122900 1.71475283 1.31634348 -15.91244799 -3.30493662 12.97184060