element(s):
['Al']
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:
['4.039']
model name:
EAM_Dynamo_LiuErcolessiAdams_2004_Al__MO_051157671505_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  225
cell =  [[4.039, 0, 0], [0, 4.039, 0], [0, 0, 4.039]]
=========================================
      Step     Time          Energy          fmax
BFGS:    0 15:09:19      -13.439551         0.042738
BFGS:    1 15:09:19      -13.439626         0.039065
BFGS:    2 15:09:19      -13.440001         0.000832
BFGS:    3 15:09:19      -13.440001         0.000019
BFGS:    4 15:09:19      -13.440001         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 5.112412027851324e-10 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
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 1.49270588e-36]]
cellpar =  Cell([[4.03196044166404, 5.095224410170398e-33, 3.638015964582998e-34], [3.260857118493926e-32, 4.03196044166404, 6.579457643710561e-20], [8.672330929685979e-34, 6.579457643710664e-20, 4.03196044166404]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [5.11241203e-10 5.11241203e-10 5.11241203e-10 2.12342881e-27
 5.72604436e-35 6.70907712e-52]
energy per atom =  -3.3600003697782563
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0