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=8.628142556930769 stress="-1.9369353955028992 -0.260348595905924 -0.1936288900763004 -0.260348595905924 -2.9756971910484227 -1.267663934502429 -0.1936288900763004 -1.267663934502429 -3.103639055817178" free_energy=8.628142556930769 pbc="F F T" Ta 0.04737131 0.03238783 0.24404962 -16.76249551 -30.66243429 -11.52092914 Ta 1.36810690 1.62937675 2.75818085 20.17190691 34.53110614 17.89871525 Cu 1.59119645 0.21456242 1.77913633 18.57713208 -27.05374389 -12.46857730 Cu 0.18492541 1.33178173 1.38323780 -21.98654347 23.18507204 6.09079119