element(s):
['Al']
AFLOW prototype label:
A_cI2_229_a
Parameter names:
['a']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['3.233']
model name:
EAM_Dynamo_LiuLiuBorucki_1999_AlCu__MO_020851069572_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['Al']
representative atom coordinates =  [[0 0 0]]
spacegroup =  229
cell =  [[3.233, 0, 0], [0, 3.233, 0], [0, 0, 3.233]]
=========================================
      Step     Time          Energy         fmax
BFGS:    0 09:37:14       -6.565645        0.4818
BFGS:    1 09:37:14       -6.574963        0.4204
BFGS:    2 09:37:14       -6.606476        0.0189
BFGS:    3 09:37:14       -6.606509        0.0078
BFGS:    4 09:37:14       -6.606516        0.0001
BFGS:    5 09:37:14       -6.606516        0.0000
BFGS:    6 09:37:14       -6.606516        0.0000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.469604123727257e-12 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al']
basis =  [[0.  0.  0. ]
 [0.5 0.5 0.5]]
cellpar =  Cell([[3.1480164670022006, 2.6224792025525596e-32, -4.9811248974427185e-33], [1.5987126528777222e-32, 3.1480164670022006, -7.0020708127797e-20], [-5.048946293751498e-33, -7.002070812779255e-20, 3.1480164670022006]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.46960412e-12  1.46960412e-12  1.46960412e-12 -2.29736719e-28
  2.59122563e-35 -4.06351571e-51]
energy per atom =  -3.303258152123466
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0