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_IMD_BrommerGaehler_2006A_AlNiCo__MO_122703700223_003
==== 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 16:11:10      -14.755596         0.775639
BFGS:    1 16:11:10      -14.779692         0.674152
BFGS:    2 16:11:10      -14.847068         0.229719
BFGS:    3 16:11:10      -14.856522         0.016514
BFGS:    4 16:11:10      -14.856573         0.000611
BFGS:    5 16:11:10      -14.856574         0.000003
BFGS:    6 16:11:10      -14.856574         0.000000
Minimization converged after 6 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 2.1361678938567814e-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 1.86581728e-34]]
cellpar =  Cell([[4.128871485743677, 1.2315787789396541e-32, 2.1026623719989825e-33], [1.1924238646783983e-32, 4.128871485743677, -5.625396440295038e-18], [6.674972716963753e-33, -5.62539644029504e-18, 4.128871485743677]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-2.13616789e-10 -2.13616789e-10 -2.13616789e-10  6.61575881e-27
  9.41448372e-37 -7.36759715e-53]
energy per atom =  -3.7141433776216894
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0