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_FarkasJones_1996_NbTiAl__MO_042691367780_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 15:09:21      -12.400752         1.701306
BFGS:    1 15:09:21      -12.515984         1.458892
BFGS:    2 15:09:21      -12.696429         0.941639
BFGS:    3 15:09:21      -12.797123         0.418364
BFGS:    4 15:09:21      -12.825172         0.039126
BFGS:    5 15:09:21      -12.825390         0.004002
BFGS:    6 15:09:21      -12.825392         0.000035
BFGS:    7 15:09:21      -12.825392         0.000000
BFGS:    8 15:09:21      -12.825392         0.000000
Minimization converged after 8 steps.
Maximum force component: 0.0 eV/Angstrom
Maximum stress component: 1.6673672347730248e-14 eV/Angstrom^3
==== Minimized structure obtained from ASE ====
symbols =  ['Al', 'Al', 'Al', 'Al']
basis =  [[0.  0.  0. ]
 [0.  0.5 0.5]
 [0.5 0.  0.5]
 [0.5 0.5 0. ]]
cellpar =  Cell([[3.8693369711259207, 9.784386677514988e-34, 4.026092587283045e-32], [1.2826699745856115e-32, 3.8693369711259207, 2.0687361520471544e-17], [4.8147196942482735e-33, 2.0687361520471535e-17, 3.8693369711259207]])
forces =  [[0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]
 [0. 0. 0.]]
stress =  [-1.66736723e-14 -1.66736723e-14 -1.66736723e-14 -1.68339055e-29
  3.43033166e-35  1.29293697e-50]
energy per atom =  -3.2063481150638125
===============================================
Parameter sets [0] relaxed to duplicate structures, attempting to write only one of them.
Successfully added property instance for parameter set 0