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=20.13609898683687 stress="-3.497559242767118 0.703671087827924 -0.6222543648813317 0.703671087827924 -4.710263373601756 -0.07658446029283723 -0.6222543648813317 -0.07658446029283723 -3.5203462305752486" free_energy=20.13609898683687 pbc="F T F" Zr 0.04737131 0.03238783 0.24404962 -31.41914876 -23.45556283 -41.31076505 Cu 1.36810690 1.39130086 0.09119645 29.81566414 9.76728227 -25.69531499 Zr 1.29640878 0.21456242 1.77913633 49.33490401 -30.39361365 37.35604594 Cu 0.18492541 1.33178173 1.38323780 -47.73141939 44.08189420 29.65003410