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_QuinticClampedSpline_ErcolessiAdams_1994_Al__MO_450093727396_002
==== 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 16:11:23      -13.439564         0.042325
BFGS:    1 16:11:23      -13.439638         0.038609
BFGS:    2 16:11:23      -13.440000         0.000224
BFGS:    3 16:11:23      -13.440000         0.000001
BFGS:    4 16:11:23      -13.440000         0.000000
Minimization converged after 4 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 3.5803593328221566e-12 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 1.86582569e-37]]
cellpar =  Cell([[4.032082885268424, 1.5265730771268469e-33, -1.856836662409216e-36], [1.0208088745556575e-33, 4.032082885268424, 7.394779764652366e-21], [1.826816619444272e-36, 7.394779764652375e-21, 4.032082885268424]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [ 3.58035933e-12  3.58035933e-12  3.58035933e-12 -4.07333802e-33
  4.53760107e-64 -2.04509671e-61]
energy per atom =  -3.360000001295534
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0