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 11:11:10      -83.012272       17.5779
BFGS:    1 11:11:10      -85.239577       15.0931
BFGS:    2 11:11:10      -86.924811       12.0621
BFGS:    3 11:11:10      -88.066756        8.5664
BFGS:    4 11:11:10      -88.736907        4.8938
BFGS:    5 11:11:10      -89.059968        1.8182
BFGS:    6 11:11:10      -89.175182        2.9188
BFGS:    7 11:11:10      -89.223192        1.8979
BFGS:    8 11:11:10      -89.253740        0.0366
BFGS:    9 11:11:11      -89.253752        0.0011
BFGS:   10 11:11:11      -89.253752        0.0001
BFGS:   11 11:11:11      -89.253752        0.0000
BFGS:   12 11:11:11      -89.253752        0.0000
BFGS:   13 11:11:11      -89.253752        0.0000
Minimization converged after 13 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.2954435486518337e-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]
 [1.20540954e-49 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 6.27895746e-34 5.00000000e-01]]
cellpar =  Cell([[3.6807319504956455, -2.673841149390531e-35, 3.780153926223564e-32], [6.006246037921328e-35, 3.680731950495645, 1.696723064742409e-17], [-1.0043620680211657e-32, 1.3612387308771918e-17, 3.537509590938764]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 2.28152650e-10  2.28152650e-10  2.29544355e-10 -4.97805229e-26
  1.89329653e-33 -6.08515572e-49]
energy per atom =  -22.31343791375191
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0