4
Lattice="3.653164683804359 -0.00017564836319136054 0.0 -1.826734497772937 3.16303666402671 0.0 4.888861855419445e-17 -8.68069651697662e-22 18.85580293064" Properties=species:S:1:pos:R:3:tags:I:1:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-33.25054258022623 stress="3.134426400327313e-06 9.092412379349832e-08 -4.957930534864306e-07 9.092412379349832e-08 3.7066269305421268e-06 1.353560852861662e-06 -4.957930534864306e-07 1.353560852861662e-06 5.269364592788349e-05" dipole="-2.657277729049905 1.5419013186036405 4.635377806165799e-07" magmom=0.0 free_energy=-33.26354431846333 pbc="T T F"
O        0.00006227      -0.00016162       8.08437196        0       0.00000000      -0.00000747       0.00000724      -0.00112633       0.00000000
O       -0.00016372       2.10879418      10.77278208        0       0.00000000       0.00000743      -0.00000713       0.00117772       0.00000000
Zr       0.00008195      -0.00020897      10.43326228        0       0.00000000       0.00005355      -0.00016238       0.00569233       0.00000000
Zr      -0.00018340       2.10884152       8.42385703        0       0.00000000      -0.00005349       0.00016227      -0.00559244       0.00000000