15
Lattice="10.415368141036403 -0.18547031386937526 0.0 -2.7303441489391833 7.253135986801175 0.0 -1.4983790370419242e-18 2.698431941932299e-23 18.56028974" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-65.38031835843503 stress="-2.9099170965772445e-06 -3.392486589890402e-06 -1.4472723494194388e-05 -3.392486589890402e-06 2.454093518008061e-06 6.979854806010165e-07 -1.4472723494194388e-05 6.979854806010165e-07 1.2484678663781076e-05" dipole="5.986346032186553 13.771066485211312 -0.051876363829225024" magmom=0.0 free_energy=-65.38031835844971 pbc="T T F"
Al       1.06494795       7.12143188       9.42959208       0.00000000       0.00425948       0.00050513       0.00228348       0.00000000
Al       9.38026183       1.47674789       8.68184563       0.00000000      -0.00012189       0.00214771      -0.00115252       0.00000000
Al       5.25359720       6.10476709       9.70630694       0.00000000       0.00066709       0.00202558      -0.00088448       0.00000000
Al       1.03497054       4.42410489       8.97555999       0.00000000      -0.00357473      -0.00308270      -0.00236218       0.00000000
Al       6.55644560       2.53553513       9.81940929       0.00000000      -0.00103162      -0.00222335       0.00153307       0.00000000
Al      -1.99167298       5.41239871       8.88788808       0.00000000      -0.00476920      -0.00208520       0.00286984       0.00000000
Se       2.92992913       5.59208390      10.02758258       0.00000000      -0.00445889      -0.00049253       0.00522988       0.00000000
Se      -0.35897860       5.52088049      10.74763949       0.00000000       0.00202584      -0.00221541      -0.00126663       0.00000000
Se       1.22609605       2.17411181       8.44954970       0.00000000       0.00089341      -0.00297751      -0.00216029       0.00000000
Se       6.70833999       4.67884604      10.95177977       0.00000000       0.00811804       0.00275422      -0.00375767       0.00000000
Se       8.25347328       1.04604736      10.83414448       0.00000000       0.00104482      -0.00084400       0.00017596       0.00000000
Se       4.25517224       2.10251858       9.88890528       0.00000000      -0.00130247       0.00325964       0.00032659       0.00000000
Se       0.09586987       6.05831207       7.39167607       0.00000000      -0.00427594      -0.00031249       0.00202363       0.00000000
Se       7.79405882       3.06390449       7.73343318       0.00000000      -0.00126479       0.00148835      -0.00051975       0.00000000
Se       6.54923842       6.48273768       7.67686124       0.00000000       0.00384882       0.00198126      -0.00244373       0.00000000