element(s):
['Cu', 'Zr']
AFLOW prototype label:
A5B_cF24_216_ae_c
Parameter names:
['a', 'x3']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['6.8929', '0.62583382']
model name:
EAM_Dynamo_MendelevKramerOtt_2009_CuZr__MO_600021860456_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Cu', 'Cu', 'Zr']
representative atom coordinates =  [[0.         0.         0.        ]
 [0.62583382 0.62583382 0.62583382]
 [0.25       0.25       0.25      ]]
spacegroup =  216
cell =  [[6.8929, 0, 0], [0, 6.8929, 0], [0, 0, 6.8929]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 16:44:09      -92.350928         0.093752
BFGS:    1 16:44:10      -92.352692         0.070108
BFGS:    2 16:44:10      -92.354933         0.005044
BFGS:    3 16:44:10      -92.354934         0.004894
BFGS:    4 16:44:10      -92.354951         0.000022
BFGS:    5 16:44:10      -92.354951         0.000001
BFGS:    6 16:44:10      -92.354951         0.000000
Minimization converged after 6 steps.
Maximum force component: 8.057269656507438e-12 eV/Angstrom
Maximum stress component: 3.758768637744779e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Zr', 'Zr', 'Zr', 'Zr']
basis =  [[7.96051044e-33 0.00000000e+00 7.96051044e-33]
 [3.78779387e-42 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 7.96556000e-33 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 3.49213503e-36]
 [6.26276104e-01 6.26276104e-01 6.26276104e-01]
 [3.73723896e-01 3.73723896e-01 6.26276104e-01]
 [3.73723896e-01 6.26276104e-01 3.73723896e-01]
 [6.26276104e-01 3.73723896e-01 3.73723896e-01]
 [6.26276104e-01 1.26276104e-01 1.26276104e-01]
 [3.73723896e-01 8.73723896e-01 1.26276104e-01]
 [3.73723896e-01 1.26276104e-01 8.73723896e-01]
 [6.26276104e-01 8.73723896e-01 8.73723896e-01]
 [1.26276104e-01 6.26276104e-01 1.26276104e-01]
 [8.73723896e-01 3.73723896e-01 1.26276104e-01]
 [8.73723896e-01 6.26276104e-01 8.73723896e-01]
 [1.26276104e-01 3.73723896e-01 8.73723896e-01]
 [1.26276104e-01 1.26276104e-01 6.26276104e-01]
 [8.73723896e-01 8.73723896e-01 6.26276104e-01]
 [8.73723896e-01 1.26276104e-01 3.73723896e-01]
 [1.26276104e-01 8.73723896e-01 3.73723896e-01]
 [2.50000000e-01 2.50000000e-01 2.50000000e-01]
 [7.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 7.50000000e-01]]
cellpar =  Cell([[6.893812553188937, 5.645645768345844e-34, -8.028811049490867e-34], [2.847932286781583e-40, 6.893812553188937, 2.61308392888595e-19], [8.220457372433631e-33, 2.6130839288858555e-19, 6.893812553188937]])
forces =  [[ 7.08106668e-33  7.08106668e-33  7.08106668e-33]
 [ 7.08106668e-33 -7.08106668e-33  7.08106668e-33]
 [-7.08106668e-33  7.08106668e-33 -7.08106668e-33]
 [-7.08106668e-33  7.08106668e-33  7.08106668e-33]
 [-8.05726966e-12 -8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12  8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12 -8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12  8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12 -8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12  8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12 -8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12  8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12 -8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12  8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12 -8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12  8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12 -8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12  8.05726966e-12 -8.05726966e-12]
 [ 8.05726966e-12 -8.05726966e-12  8.05726966e-12]
 [-8.05726966e-12  8.05726966e-12  8.05726966e-12]
 [ 2.69080534e-31 -2.74391334e-31 -4.14242401e-31]
 [ 3.89458667e-32  2.83242667e-32 -7.43512002e-32]
 [-2.26594134e-31 -3.73083701e-31 -2.69080534e-31]
 [-4.24864001e-32  1.41621334e-32 -1.13297067e-31]]
stress =  [-3.75876864e-14 -3.75876864e-14 -3.75876864e-14  1.76149322e-29
  2.16132597e-35 -7.76568525e-51]
energy per atom =  -3.8481229482307566
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0