element(s):
['Al', 'Cu']
AFLOW prototype label:
AB3_cF16_225_a_bc
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.8417']
model name:
EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al', 'Cu', 'Cu']
representative atom coordinates =  [[0.   0.   0.  ]
 [0.5  0.5  0.5 ]
 [0.25 0.25 0.25]]
spacegroup =  225
cell =  [[5.8417, 0, 0], [0, 5.8417, 0], [0, 0, 5.8417]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:54:16      -57.972401         0.248121
BFGS:    1 15:54:16      -57.975003         0.241214
BFGS:    2 15:54:16      -58.003961         0.145436
BFGS:    3 15:54:17      -58.018785         0.052562
BFGS:    4 15:54:17      -58.021064         0.001320
BFGS:    5 15:54:17      -58.021066         0.000015
BFGS:    6 15:54:17      -58.021066         0.000000
Minimization converged after 6 steps.
Maximum force component: 7.347085794213882e-31 eV/Angstrom
Maximum stress component: 3.2753908736581746e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu', 'Cu']
basis =  [[0.00000000e+00 0.00000000e+00 0.00000000e+00]
 [0.00000000e+00 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 5.00000000e-01]
 [5.00000000e-01 5.00000000e-01 0.00000000e+00]
 [5.00000000e-01 5.00000000e-01 5.00000000e-01]
 [5.00000000e-01 0.00000000e+00 2.90414050e-50]
 [0.00000000e+00 5.00000000e-01 0.00000000e+00]
 [1.45207025e-50 3.26977151e-35 5.00000000e-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]
 [2.50000000e-01 2.50000000e-01 7.50000000e-01]
 [7.50000000e-01 7.50000000e-01 7.50000000e-01]
 [2.50000000e-01 7.50000000e-01 2.50000000e-01]
 [7.50000000e-01 2.50000000e-01 2.50000000e-01]]
cellpar =  Cell([[5.890105582400813, 3.4643905260014207e-34, -2.4826789758471997e-33], [-3.189507204175469e-33, 5.890105582400813, 2.3529228799014546e-18], [1.3396639888817933e-33, 2.352922879901453e-18, 5.890105582400813]])
forces =  [[ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [ 0.00000000e+00  0.00000000e+00  0.00000000e+00]
 [-3.63005783e-32 -2.48053952e-31  1.63352602e-31]
 [-9.30202319e-32  2.72254337e-32 -3.99306361e-31]
 [-7.37355497e-33 -3.38805397e-31  4.35606940e-31]
 [-1.81502891e-31  3.33511563e-31 -1.99653181e-31]
 [-6.05009638e-33 -6.05009638e-31  3.02504819e-31]
 [ 5.68709060e-31  6.84039022e-31  5.86859349e-31]
 [ 4.96107903e-31  4.38631988e-31 -7.34708579e-31]
 [-9.01369828e-32 -7.13911373e-31 -6.73073223e-32]]
stress =  [-3.27539087e-10 -3.27539087e-10 -3.27539087e-10  6.02220262e-27
 -1.48034540e-35  1.44424449e-52]
energy per atom =  -3.626316600355013
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0