4
Lattice="3.757360932512288 -0.00017216459213985612 0.0 -1.878829561002816 3.253870305820697 0.0 2.381938849444069e-16 5.360280180614442e-21 19.53811720680754" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-15.340762187201289 stress="-6.318541856079945e-05 -7.589303419369785e-07 2.833740821594993e-07 -7.589303419369785e-07 -6.42783280998183e-05 2.6811278738430444e-07 2.833740821594993e-07 2.6811278738430444e-07 0.0007421519364828867" dipole="-1.2861240051516023 0.7000747480836947 -1.3271373305565465e-06" magmom=0.0 free_energy=-15.417281357916709 pbc="T T F"
Cu      -0.00019006       2.17084639      11.49195809       0.00000000       0.00019744      -0.00001168       0.00428315       0.00000000
S        1.87861182       1.08688016       7.91569338       0.00000000       0.00021090      -0.00024379       0.00959172       0.00000000
S        0.00002178       0.00159773      11.62238885       0.00000000      -0.00020089      -0.00001584      -0.00960014       0.00000000
Cu      -0.00000495       2.17147795       8.04610639       0.00000000      -0.00020693       0.00027051      -0.00427348       0.00000000