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 15:44:55       -6.565645         0.481788
BFGS:    1 15:44:55       -6.574963         0.420387
BFGS:    2 15:44:55       -6.606476         0.018945
BFGS:    3 15:44:55       -6.606509         0.007792
BFGS:    4 15:44:55       -6.606516         0.000089
BFGS:    5 15:44:55       -6.606516         0.000000
BFGS:    6 15:44:55       -6.606516         0.000000
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, -1.3051332381148847e-32, 4.9392342075314076e-33], [-5.750553752003545e-33, 3.1480164670022006, -6.367170175629019e-20], [-1.0341249394413372e-32, -6.367170175627492e-20, 3.1480164670022006]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 1.46960412e-12  1.46960412e-12  1.46960412e-12 -3.54639543e-29
 -5.18245127e-35  2.71077464e-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