element(s):
['Al', 'Cu', 'Pt']
AFLOW prototype label:
ABC2_tP4_123_a_c_e
Parameter names:
['a', 'c/a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.9869', '0.87576814']
model name:
LJ_ElliottAkerson_2015_Universal__MO_959249795837_003
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Cu', 'Pt']
representative atom coordinates =  [[0.  0.  0. ]
 [0.5 0.5 0. ]
 [0.  0.5 0.5]]
spacegroup =  123
cell =  [[3.9869, 0, 0], [0, 3.9869, 0], [0, 0, 3.4916]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 19:55:24      -83.012272        17.577935
BFGS:    1 19:55:24      -85.239577        15.093080
BFGS:    2 19:55:24      -86.924811        12.062065
BFGS:    3 19:55:24      -88.066756         8.566404
BFGS:    4 19:55:24      -88.736907         4.893839
BFGS:    5 19:55:24      -89.059968         1.818153
BFGS:    6 19:55:24      -89.175182         2.918842
BFGS:    7 19:55:24      -89.223192         1.897928
BFGS:    8 19:55:24      -89.253740         0.036613
BFGS:    9 19:55:24      -89.253752         0.001127
BFGS:   10 19:55:24      -89.253752         0.000089
BFGS:   11 19:55:24      -89.253752         0.000004
BFGS:   12 19:55:24      -89.253752         0.000000
BFGS:   13 19:55:24      -89.253752         0.000000
Minimization converged after 13 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.2953078906894115e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Cu', 'Pt', 'Pt']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [2.54152615e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 3.13947873e-34 5.00000000e-01]]
cellpar =  Cell([[3.6807319504956437, 7.443668832163848e-35, -1.904552678421826e-32], [8.111361959275351e-35, 3.6807319504956446, -4.1362669636602966e-18], [-2.0092601911267335e-32, -3.3271268771515307e-18, 3.537509590938763]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [2.28139388e-10 2.28139388e-10 2.29530789e-10 7.57782547e-26
 9.46648264e-34 3.59053032e-49]
energy per atom =  -22.313437913751894
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0