element(s): ['Co'] AFLOW prototype label: A_cF4_225_a Parameter names: ['a'] model type (only 'standard' supported at this time): standard number of parameter sets: 1 Parameter values for parameter set 0: ['3.5722'] model name: EAM_Dynamo_FarkasCaro_2020_FeNiCrCoAl__MO_820335782779_000 ==== Building ASE atoms object with: ==== representative atom symbols = ['Co'] representative atom coordinates = [[0 0 0]] spacegroup = 225 cell = [[3.5722, 0, 0], [0, 3.5722, 0], [0, 0, 3.5722]] ========================================= Step Time Energy fmax BFGS: 0 16:50:05 -17.629189 0.2916 BFGS: 1 16:50:05 -17.632525 0.2422 BFGS: 2 16:50:06 -17.639998 0.0033 BFGS: 3 16:50:06 -17.640000 0.0001 BFGS: 4 16:50:06 -17.640000 0.0000 BFGS: 5 16:50:06 -17.640000 0.0000 Minimization converged after 5 steps. Maximum force component: 0.0 eV/Angstrom Maximum stress component: 3.619175758381358e-14 eV/Angstrom^3 ==== Minimized structure obtained from ASE ==== symbols = ['Co', 'Co', 'Co', 'Co'] basis = [[0.00000000e+00 0.00000000e+00 0.00000000e+00] [4.81850552e-50 5.00000000e-01 5.00000000e-01] [5.00000000e-01 1.65562589e-39 5.00000000e-01] [5.00000000e-01 5.00000000e-01 0.00000000e+00]] cellpar = Cell([[3.5499999045830957, -2.314731883027606e-33, -4.4496495346515065e-33], [2.3147021486335847e-33, 3.5499999045830957, 6.91502100583379e-23], [-4.018344405361447e-34, 6.915021005428717e-23, 3.5499999045830957]]) forces = [[0. 0. 0.] [0. 0. 0.] [0. 0. 0.] [0. 0. 0.]] stress = [3.61917576e-14 3.61917576e-14 3.61917576e-14 1.60724869e-29 2.03761693e-35 4.52442515e-51] energy per atom = -4.409999958753299 =============================================== Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them. Successfully added property instance for parameter set 0